SCHEMBL3671509

SCHEMBL3671509

COc1ccccc1CC1=CC(=O)NC1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.46
IDH1 O75874 1/20 0.43
PNP P00491 1/20 0.42
CNR2 P34972 4/20 0.42
IDO1 P14902 2/20 0.41
TAAR1 Q96RJ0 1/20 0.41
GPR55 Q9Y2T6 2/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
DAO P14920 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
SCHEMBL1133787 0.83 GSK3B (0.34) MAPT
SCHEMBL3680064 0.82 HRH1 (0.44) GAA
SCHEMBL3675473 0.79 AR (0.42) ARCNR2TAAR1GPR55ALDH1A1
SCHEMBL19439526 0.76 DAO (0.44) ARIDO1TAAR1KDM4EL3MBTL1
SCHEMBL28306305 0.76 HSPA5 (0.50) IDH1IDO1TAAR1DAO
SCHEMBL1542665 0.74 CA2 (0.56) KDM4EHTTALDH1A1MAPTDAO
SCHEMBL28342480 0.73 DAO (0.34) ARCNR2GPR55MAPTDAO
SCHEMBL27093593 0.73 MAOA (0.53) ARIDH1CNR2IDO1TAAR1
SCHEMBL3296809 0.73 IDO1 (0.61) CNR2IDO1TAAR1CHRM2CHRM1
SCHEMBL3677686 0.72 TAAR1 (0.41) TAAR1L3MBTL1MAPTDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825188-B2 Thermoplastic elastomer with acyloxyphenyl hard block segment DESIGNER MOLECULES, INC. (US) 2010-11-02 US claimed
WO-2008077141-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2008-06-26 WO claimed
US-20080146738-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. 2008-06-19 US claimed
US-7825188-B2 Thermoplastic elastomer with acyloxyphenyl hard block segment DESIGNER MOLECULES, INC. (US) 2010-11-02 US disclosed
WO-2008077141-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2008-06-26 WO disclosed
US-20080146738-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. 2008-06-19 US disclosed