SCHEMBL24747459

SCHEMBL24747459

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 5/20 0.43
KLK7 P49862 1/20 0.43
SQOR Q9Y6N5 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 3/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
JMJD6 Q6NYC1 1/20 0.41
TSHR P16473 1/20 0.40
DPP4 P27487 1/20 0.40
POLB P06746 3/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL24747457 0.90 ALDH1A1 (0.45) KDM4EALDH1A1KLK7SQORSMN1; SMN2
SCHEMBL24747450 0.90 MAPT (0.49) KDM4EALDH1A1KLK7SQORSMN1; SMN2
SCHEMBL24750701 0.89 KDM4E (0.48) KDM4EALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL24747871 0.89 TSHR (0.51) KDM4EALDH1A1KLK7SQORSMN1; SMN2
SCHEMBL24748849 0.89 CSNK1D (0.46) KDM4EALDH1A1KLK7SMN1; SMN2MAPT
SCHEMBL24407439 0.88 ALDH1A1 (0.44) KDM4EALDH1A1KLK7SQORSMN1; SMN2
SCHEMBL24748274 0.86 KDM4E (0.44) KDM4EALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL24747532 0.86 PTGDR2 (0.46) KDM4EALDH1A1
SCHEMBL26940102 0.83 MEN1 (0.50) KDM4EALDH1A1KLK7SMN1; SMN2MAPT
SCHEMBL26940248 0.82 KDM4E (0.37) KDM4EALDH1A1KLK7SQORSMN1; SMN2

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 KDM4E 3720/4885ALDH1A1 83/4885KLK7 4119/4885
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 KDM4E 2866/4885ALDH1A1 36/4885KLK7 3628/4885

“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.