SCHEMBL3971788

SCHEMBL3971788

O=CCc1ccc(Cl)c(F)c1.OCCc1ccc(Cl)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ BACE1 P56817 1/20 0.38
▸ PNMT P11086 1/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ SIGMAR1 Q99720 2/20 0.35
▸ PPARG P37231 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ CA2 P00918 1/20 0.33
▸ RPS6KA1 Q15418 1/20 0.33
▸ PTGES2 Q9H7Z7 1/20 0.33
▸ IGF1R P08069 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ GRM2 Q14416 1/20 0.32

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
SCHEMBL2173678 0.88 MAPT (0.39) MAPTALDH1A1PNMTTAAR1MAPK1
SCHEMBL3978582 0.88 MAPT (0.47) MAPTKDM4EALDH1A1ALOX5GAA
SCHEMBL1568015 0.80 PNMT (0.41) MAPTPNMTTAAR1MAPK1KCNH2
SCHEMBL3973326 0.79 MAPT (0.39) MAPTKDM4EALDH1A1ALOX5GAA
SCHEMBL1568422 0.78 IGF1R (0.44) MAPTPNMTTAAR1MAPK1SIGMAR1
SCHEMBL28920633 0.73 PPARG (0.38) MAPTMAPK1KCNH2PPARGPPARA
SCHEMBL2172166 0.73 PIK3CA (0.45) MAPTALDH1A1PNMTTAAR1ALOX15
SCHEMBL3264645 0.73 MAPT (0.47) MAPTKDM4EALDH1A1ALOX5GAA
SCHEMBL14656091 0.73 HTR2A (0.47) MAPTALDH1A1KCNH2PPARGPPARA
SCHEMBL2092848 0.73 MAPT (0.45) MAPTPNMTTAAR1MAPK1PPARG

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
EP-2054410-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS Wyeth (US) 2009-05-06 — — EP disclosed
WO-2008021331-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS WYETH (US) 2008-02-21 — — WO disclosed
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