SCHEMBL20733907

SCHEMBL20733907

CCOC(=O)c1ncc(C)cc1SCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
XBP1 P17861 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TLR9 Q9NR96 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GLP1R P43220 1/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24212467 0.87 CA12 (0.42) ALDH1A1HTTSMN1; SMN2MAPTNPC1
SCHEMBL26502532 0.87 ALDH1A1 (0.39) ALDH1A1HTTSMN1; SMN2MAPTNPC1
SCHEMBL29360771 0.87 CA12 (0.42) ALDH1A1HTTSMN1; SMN2MAPTNPC1
SCHEMBL17986657 0.85 CYP1A2 (0.41) ALDH1A1HTTSMN1; SMN2MAPTNPC1
SCHEMBL23413547 0.85 ALDH1A1 (0.44) ALDH1A1HTTMAPTNPC1TP53
SCHEMBL29362361 0.85 TARBP2 (0.39) ALDH1A1HTTSMN1; SMN2MAPTNPC1
SCHEMBL24212384 0.85 TARBP2 (0.39) ALDH1A1HTTSMN1; SMN2MAPTNPC1
SCHEMBL17986658 0.85 GABRA2 (0.39) ALDH1A1HTTMAPTNPC1TP53
SCHEMBL17986655 0.84 CYP2C19 (0.52) ALDH1A1HTTSMN1; SMN2MAPTNPC1
SCHEMBL21151786 0.84 CYP2C9 (0.39) ALDH1A1HTTMAPTNPC1TP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787809-B2 Oxime group-containing condensed heterocyclic compound or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide NIHON NOHYAKU CO., LTD. (JP) 2023-10-17 US disclosed
EP-3372595-B1 OXIME GROUP-CONTAINING CONDENSED HETEROCYCLIC COMPOUND OR SALTS THEREOF AND AGRICULTURAL AND HORTICULTURAL INSECTICIDE CONTAINING SAID COMPOUND, AND METHOD FOR USING SAME NIHON NOHYAKU CO LTD (JP) 2023-06-28 EP disclosed
US-11208410-B2 Heterocycle-bound condensed heterocyclic compound or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide NIHON NOHYAKU CO., LTD. (JP) 2021-12-28 US disclosed
US-20210371424-A1 OXIME GROUP-CONTAINING CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 2021-12-02 US disclosed
EP-3564238-B1 FUSED HETEROCYCLIC COMPOUND HAVING OXIME GROUP OR SALTS THEREOF, AGRICULTURAL/HORTICULTURAL INSECTICIDE CONTAINING SAID COMPOUNDS, AND METHOD FOR USING SAID INSECTICIDE NIHON NOHYAKU CO LTD (JP) 2021-10-13 EP disclosed
EP-3508485-B1 HYDRAZONYL GROUP CONTAINING-CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO LTD (JP) 2021-02-24 EP disclosed
US-20200361940-A1 HETEROCYCLE-BOUND CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 2020-11-19 US disclosed
US-10575525-B2 Benzoxazole compound or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide NIHON NOHYAKU CO., LTD. (JP) 2020-03-03 US disclosed
EP-3564238-A1 FUSED HETEROCYCLIC COMPOUND HAVING OXIME GROUP OR SALTS THEREOF, AGRICULTURAL/HORTICULTURAL INSECTICIDE CONTAINING SAID COMPOUNDS, AND METHOD FOR USING SAID INSECTICIDE Nihon Nohyaku Co., Ltd. (JP) 2019-11-06 EP disclosed
EP-3508485-A1 FUSED HETEROCYCLIC COMPOUND HAVING HYDRAZONYL GROUP OR SALTS THEREOF, PESTICIDE FOR AGRICULTURAL AND HORTICULTURAL USE CONTAINING SAID COMPOUND, AND METHOD FOR USING SAME Nihon Nohyaku Co., Ltd. (JP) 2019-07-10 EP disclosed
US-10266552-B2 Condensed heterocyclic compound having cycloalkylpyridyl group or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide NIHON NOHYAKU CO., LTD. (JP) 2019-04-23 US disclosed
US-20190045786-A1 BENZOXAZOLE COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 2019-02-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210371424-A1 OXIME GROUP-CONTAINING CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE DDT, OXSR1, ODC1 ALDH1A1 1027/4885HTT 878/4885SMN1; SMN2 1953/4885
US-11787809-B2 Oxime group-containing condensed heterocyclic compound or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide DDT, OXSR1, ODC1 ALDH1A1 1027/4885HTT 878/4885SMN1; SMN2 1953/4885
US-20190045786-A1 BENZOXAZOLE COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE BROX, CYP4X1, BRD7 ALDH1A1 1845/4885HTT 1953/4885SMN1; SMN2 3351/4885
US-20200361940-A1 HETEROCYCLE-BOUND CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE HDHD5, H1-0, H1-3 ALDH1A1 780/4885HTT 482/4885SMN1; SMN2 3497/4885
US-10575525-B2 Benzoxazole compound or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide BROX, CYP4X1, BRD7 ALDH1A1 1845/4885HTT 1953/4885SMN1; SMN2 3351/4885
US-11208410-B2 Heterocycle-bound condensed heterocyclic compound or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide HDHD5, H1-0, H1-3 ALDH1A1 780/4885HTT 482/4885SMN1; SMN2 3497/4885
US-10266552-B2 Condensed heterocyclic compound having cycloalkylpyridyl group or salt thereof, agricultural and horticultural insecticide comprising the compound, and method for using the insecticide DDT, HCN3, HCN1 ALDH1A1 2344/4885HTT 697/4885SMN1; SMN2 3421/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.