SCHEMBL9756739

SCHEMBL9756739

CC(C)/C=C/C(=O)c1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.58
CYP2C19 P33261 1/20 0.58
TNFRSF1A P19438 1/20 0.56
MAPT P10636 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
ALDH1A1 P00352 4/20 0.49
ATM Q13315 3/20 0.49
MAOA P21397 2/20 0.49
KRAS P01116 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CXCL12 P48061 1/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
MAOB P27338 2/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45

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
SCHEMBL9756740 1.00 CYP1A2 (0.58) CYP1A2CYP2C19TNFRSF1AMAPTSMN1; SMN2
SCHEMBL6989989 0.81 TNFRSF1A (0.72) CYP1A2CYP2C19TNFRSF1AMAPTSMN1; SMN2
SCHEMBL6989990 0.81 TNFRSF1A (0.72) CYP1A2CYP2C19TNFRSF1AMAPTSMN1; SMN2
SCHEMBL11429551 0.81 MAPT (0.58) CYP1A2CYP2C19MAPTSMN1; SMN2ALDH1A1
SCHEMBL11490304 0.81 MAPT (0.58) CYP1A2CYP2C19MAPTSMN1; SMN2ALDH1A1
SCHEMBL5197267 0.80 RECQL (0.55) TNFRSF1AMAPTSMN1; SMN2ALDH1A1MAOB
SCHEMBL5197269 0.80 RECQL (0.55) TNFRSF1AMAPTSMN1; SMN2ALDH1A1MAOB
SCHEMBL9519390 0.79 F3 (0.64) TNFRSF1AMAPTALDH1A1MAOAMAOB
SCHEMBL11298787 0.79 F3 (0.64) TNFRSF1AMAPTALDH1A1MAOAMAOB
SCHEMBL956091 0.78 CYP1A2 (0.63) CYP1A2CYP2C19TNFRSF1AMAPTSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025072392-A1 TRIAZOLOPYRIDINYL ETHER LINKED COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed
US-9540350-B2 1-substituted, 4-(substituted phenoxymethyl)-1,2,3-triazole compounds with antifungal properties and methods for preparation thereof FDC LIMITED (IN) 2017-01-10 US disclosed
US-20160009692-A1 1-SUBSTITUTED, 4-(SUBSTITUTED PHENOXYMETHYL)-1,2,3-TRIAZOLE COMPOUNDS WITH ANTIFUNGAL PROPERTIES AND METHODS FOR PREPARATION THEREOF FDC LIMITED (IN) 2016-01-14 US disclosed
US-4992462-A Inhibitor of HMG-CoA reductase BAYER AKTIENGESELLSCHAFT (DE) 1991-02-12 US disclosed
EP-0287890-A1 Substituted pyrroles BAYER AG (DE) 1988-10-26 EP 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-20160009692-A1 1-SUBSTITUTED, 4-(SUBSTITUTED PHENOXYMETHYL)-1,2,3-TRIAZOLE COMPOUNDS WITH ANTIFUNGAL PROPERTIES AND METHODS FOR PREPARATION THEREOF ERG28, CYP51A1, CYP2E1 CYP1A2 30/4885CYP2C19 78/4885TNFRSF1A 4777/4885

“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.