SCHEMBL13429930

SCHEMBL13429930

CC(C)Oc1c(S)ccc(C=O)c1Br

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.37
ERN1 O75460 1/20 0.31
TYR P14679 1/20 0.31
CYP1A2 P05177 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL12440950 0.81 ALDH1A3 (0.38) ALDH1A3ERN1TYRCYP1A2MAPT
SCHEMBL9945972 0.80 ALDH1A3 (0.37) ALDH1A3ERN1TYRCYP1A2MAPT
SCHEMBL16687422 0.79 ALDH1A3 (0.36) ALDH1A3ERN1TYR
SCHEMBL12514805 0.79 ALDH1A3 (0.36) ALDH1A3ERN1TYR
SCHEMBL27808041 0.71 ALDH1A1 (0.35) ERN1
SCHEMBL16098198 0.70 MAPT (0.42) ERN1MAPTCYP2C9CYP2C19
SCHEMBL38651684 0.70 ALDH1A3 (0.37) ALDH1A3ERN1TYRCYP1A2MAPT
SCHEMBL22011034 0.69 CA1 (0.43) ALDH1A3ERN1CYP1A2MAPTCYP2C9
SCHEMBL8940219 0.69 ERN1 (0.43) ALDH1A3ERN1CYP1A2MAPTCYP2C9
SCHEMBL13429940 0.67 GABRA1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 US disclosed
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 US disclosed
EP-2110398-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE Sumitomo Chemical Company, Limited (JP) 2009-10-21 EP disclosed