SCHEMBL21723076

SCHEMBL21723076

CCOC(=O)COc1ccc(S(=O)(=O)CP(=O)(OCC)OCC)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.64
GAA P10253 2/20 0.64
POLB P06746 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
TSHR P16473 5/20 0.49
ATM Q13315 1/20 0.47
ALDH1A1 P00352 3/20 0.45
TP53 P04637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPK1 P28482 1/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL21723650 0.87 ALDH1A1 (0.55) NPSR1GAAPOLBSMN1; SMN2TSHR
SCHEMBL23542681 0.78 TP53 (0.59) GAAPOLBSMN1; SMN2ALDH1A1TP53
SCHEMBL31248428 0.78 USP2 (0.46) NPSR1GAASMN1; SMN2ALDH1A1KDM4E
SCHEMBL1374250 0.77 ALDH1A1 (0.47) GAAALDH1A1TP53MAPTHPGD
SCHEMBL2346864 0.76 GAA (0.77) NPSR1GAAPOLBSMN1; SMN2TSHR
SCHEMBL23919240 0.76 KMT2A (0.51) GAATSHRKMT2A
SCHEMBL7779173 0.75 NPSR1 (0.66) NPSR1GAAPOLBSMN1; SMN2TSHR
SCHEMBL11815554 0.74 GAA (0.72) NPSR1GAAPOLBSMN1; SMN2ALDH1A1
SCHEMBL23732506 0.73 GAA (0.55) GAASMN1; SMN2TSHRALDH1A1
SCHEMBL31248447 0.73 CA12 (0.44) POLBTSHRALDH1A1KDM4EHSD17B10

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12234207-B2 Halo-(3-(phenylsulfonyl)prop-1-enyl)pyridine derivative and use thereof CUREVERSE INCORPORATED (KR) 2025-02-25 US disclosed
US-20210317083-A1 NOVEL HALO-(3-(PHENYLSULFONYL)PROP-1-ENYL)PYRIDINE DERIVATIVE AND USE THEREOF CUREVERSE INCORPORATED (KR) 2021-10-14 US disclosed
US-20210317083-A1 NOVEL HALO-(3-(PHENYLSULFONYL)PROP-1-ENYL)PYRIDINE DERIVATIVE AND USE THEREOF CUREVERSE INCORPORATED (KR) 2021-10-14 US disclosed
EP-3838896-A1 NOVEL HALO-(3-(PHENYLSULFONYL)PROP-1-ENYL)PYRIDINE DERIVATIVE AND USE THEREOF Korea Institute of Science and Technology (KR) 2021-06-23 EP disclosed
CN-112930345-A Novel halo- (3- (phenylsulfonyl) prop-1-ene) pyridine derivatives and uses thereof 韩国科学技术研究院 2021-06-08 CN disclosed
WO-2020036474-A1 NOVEL HALO-(3-(PHENYLSULFONYL)PROP-1-ENYL)PYRIDINE DERIVATIVE AND USE THEREOF 한국과학기술연구원 2020-02-20 WO 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 (2 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-20210317083-A1 NOVEL HALO-(3-(PHENYLSULFONYL)PROP-1-ENYL)PYRIDINE DERIVATIVE AND USE THEREOF KEAP1, NFE2L2, BACH1 NPSR1 3057/4885GAA 2123/4885POLB 2663/4885
US-12234207-B2 Halo-(3-(phenylsulfonyl)prop-1-enyl)pyridine derivative and use thereof KEAP1, NFE2L2, NQO1 NPSR1 2856/4885GAA 2114/4885POLB 2502/4885

“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.