SCHEMBL5349629

SCHEMBL5349629

CCc1cccc(C#C[Si](C)(C)C)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 5/20 0.53
GABRB2 P47870 5/20 0.53
CYP2D6 P10635 2/20 0.37
CYP2C19 P33261 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CREBBP Q92793 1/20 0.36
ELANE P08246 1/20 0.34
FFAR1 O14842 1/20 0.33
IAPP P10997 3/20 0.33
PTPN5 P54829 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
SCHEMBL5351263 0.87 GABRA1 (0.37) GABRA1GABRB2CYP2D6CYP2C19KDM4E
SCHEMBL5346793 0.84 ALOX5 (0.44) GABRA1GABRB2CYP2D6CYP2C19KDM4E
SCHEMBL5348955 0.83 ALOX5 (0.50) KDM4EMAPTHSD17B10ELANEIAPP
SCHEMBL5346129 0.82 ALOX5 (0.49) KDM4EMEN1CYP3A4MAPTTSHR
SCHEMBL2809244 0.77 ALDH1A1 (0.48) GABRA1GABRB2CYP2D6CYP2C19KDM4E
SCHEMBL4307952 0.75 KDM4E (0.39) CYP2D6CYP2C19KDM4EMEN1ALDH1A1
SCHEMBL11230027 0.74 GABRA1 (0.61) GABRA1GABRB2ALDH1A1TSHR
SCHEMBL20945362 0.73 KDM4E (0.43) CYP2D6CYP2C19KDM4EMEN1ALDH1A1
SCHEMBL29791106 0.73 KDM4E (0.43) CYP2D6CYP2C19KDM4EMEN1ALDH1A1
SCHEMBL199730 0.72 GABRA1 (1.00) GABRA1GABRB2IAPPPTPN5DAO

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
US-7291692-B2 Polyarylene oxide and method of producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-06 US disclosed
US-20050096452-A1 Polyarylene oxide and method of producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-05 US disclosed