SCHEMBL7920156

SCHEMBL7920156

CCCCCCCCc1ccc2c(F)c(-c3ccc(OCCCCCC)cc3)c(F)cc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLCO1B3 Q9NPD5 1/20 0.43
SLCO1B1 Q9Y6L6 1/20 0.43
RAB9A P51151 3/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RARB P10826 7/20 0.39
NR5A1 Q13285 1/20 0.39
RARA P10276 2/20 0.39
RARG P13631 1/20 0.39
NPC1 O15118 2/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL5722885 0.91 MEN1 (0.43) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL8038196 0.89 RARB (0.47) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL7928543 0.85 DHODH (0.38) MEN1USP2ALDH1A1CYP3A4KMT2A
SCHEMBL14526059 0.82 GCGR (0.45) RARBRARARARG
SCHEMBL7558756 0.81 CNR2 (0.46) MEN1CYP3A4MAPK1KMT2AMAPT
SCHEMBL7925854 0.79 MEN1 (0.35) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL7558492 0.79 MAPK1 (0.43) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL15362600 0.78 CYP3A4 (0.42) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL15625646 0.78 CYP3A4 (0.42) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL7557453 0.77 RARB (0.46) MEN1USP2ALDH1A1LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946474-B1 1,3-DIFLUORONAPTHALENE DERIVATIVES FOR LIQUID CRYSTAL MIXTURES AVENTIS RES & TECH GMBH & CO (DE) 2001-11-07 EP disclosed
US-6159561-A FOR FERROELECTRIC SWITCHING AND/OR DISPLAY DEVICES HOECHST AKTIENGESELLSCHAFT (DE) 2000-12-12 US disclosed
EP-0946474-A1 1,3-DIFLUORONAPTHALENE DERIVATIVES FOR LIQUID CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1999-10-06 EP disclosed
WO-1998027037-A1 1,3-DIFLUORONAPTHALENE DERIVATIVES FOR LIQUID CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1998-06-25 WO disclosed