SCHEMBL24748849

SCHEMBL24748849

CCOC(=O)COc1nc(-c2cccc(OC)c2)n(O)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.46
ALDH1A1 P00352 8/20 0.45
KDM4E B2RXH2 6/20 0.45
HPGD P15428 4/20 0.45
HSD17B10 Q99714 3/20 0.45
TP53 P04637 2/20 0.45
PTPN1 P18031 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 2/20 0.42
F9 P00740 1/20 0.42
F10 P00742 1/20 0.42
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 4/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
THRB P10828 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL24748280 0.91 TSHR (0.49) ALDH1A1KDM4EHPGDSMN1; SMN2TSHR
SCHEMBL24407504 0.89 CSNK1D (0.46) CSNK1DALDH1A1KDM4EHPGDHSD17B10
SCHEMBL24747459 0.89 KDM4E (0.43) ALDH1A1KDM4EHPGDHSD17B10TP53
SCHEMBL24748837 0.87 LMNA (0.53) ALDH1A1KDM4EHPGDHSD17B10TP53
SCHEMBL24750689 0.86 GSK3B (0.47) ALDH1A1KDM4EHPGDHSD17B10TP53
SCHEMBL24747457 0.85 ALDH1A1 (0.45) CSNK1DALDH1A1KDM4EHPGDHSD17B10
SCHEMBL24747450 0.85 MAPT (0.49) ALDH1A1KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL24747871 0.85 TSHR (0.51) ALDH1A1KDM4EHPGDHSD17B10TP53
SCHEMBL24750701 0.80 KDM4E (0.48) ALDH1A1KDM4ESMN1; SMN2TSHRGAA
SCHEMBL24748274 0.80 KDM4E (0.44) ALDH1A1KDM4EHPGDHSD17B10TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382874-A1 [(5-PHENYL-1-HETEROARYL-1H-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-30 US disclosed
US-20220388971-A1 [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND SALTS THEREOF, CROP PROTECTION COMPOSITIONS COMPRISING THEM, METHODS FOR PRODUCING THEM AND USE THEREOF AS SAFENERS BAYER AKTIENGESELLSCHAFT (DE) 2022-12-08 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 (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-20230382874-A1 [(5-PHENYL-1-HETEROARYL-1H-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS CYP4Z1, PDK3, HACL2 CSNK1D 885/4885ALDH1A1 83/4885KDM4E 3720/4885
US-20220388971-A1 [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND SALTS THEREOF, CROP PROTECTION COMPOSITIONS COMPRISING THEM, METHODS FOR PRODUCING THEM AND USE THEREOF AS SAFENERS CYP4Z1, GSTO1, AADAC CSNK1D 855/4885ALDH1A1 36/4885KDM4E 2866/4885

“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.