SCHEMBL6471925

SCHEMBL6471925

COc1ccc(-c2nc(-c3cc(C(=O)O)c(C)n3Cc3cc(OC)cc(OC)c3)cs2)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
EIF4E P06730 9/20 0.47
HPGD P15428 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
ATM Q13315 1/20 0.46
KLKB1 P03952 1/20 0.45
CYP19A1 P11511 1/20 0.43
CDC25A P30304 1/20 0.42
CDC25B P30305 1/20 0.42
CDC25C P30307 1/20 0.42
DUSP3 P51452 1/20 0.42

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
SCHEMBL5045711 0.94 KDM4E (0.55) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6882640 0.93 KDM4E (0.52) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6879060 0.92 KDM4E (0.53) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6883231 0.92 KDM4E (0.50) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6883228 0.92 EIF4E (0.50) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6881310 0.91 KDM4E (0.49) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6471994 0.90 KDM4E (0.51) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6471628 0.90 KDM4E (0.50) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6883083 0.89 ALDH1A1 (0.49) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL6472401 0.89 KDM4E (0.49) KDM4EALDH1A1NPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583762-A1 PYRROLYL-THIAZOLES AND THEIR USE AS CB 1 RECEPTOR INVERSE AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-10-12 EP disclosed
US-20040147572-A1 Novel pyrrolyl-thiazole derivatives HOFFMAN-LA ROCHE INC. 2004-07-29 US disclosed
WO-2004060888-A1 NOVEL CB 1 RECEPTOR INVERSE AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-07-22 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 (1 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-20040147572-A1 Novel pyrrolyl-thiazole derivatives CNR1, CNR2, NPY1R KDM4E 2916/4885ALDH1A1 959/4885NPC1 500/4885

“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.