SCHEMBL13429623

SCHEMBL13429623

CO[Si](OC)(OC)c1ccc(-c2cccc(Br)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 8/20 0.49
GABRB3 P28472 8/20 0.49
GABRA5 P31644 8/20 0.49
GABRA3 P34903 8/20 0.49
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
GABRA1 P14867 7/20 0.41
BIRC5 O15392 1/20 0.39
TSHR P16473 3/20 0.39
TP53 P04637 2/20 0.39
TDP2 O95551 1/20 0.38

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
SCHEMBL13429730 0.84 GABRG2 (0.47) GABRG2GABRB3GABRA5GABRA3NPC1
SCHEMBL13429719 0.83 IDO1 (0.33) GABRG2GABRB3GABRA5GABRA3NPC1
SCHEMBL13429624 0.81 ALDH1A1 (0.42) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL2324534 0.79 ALDH1A1 (0.43) GABRG2GABRB3GABRA5GABRA3MAPT
SCHEMBL15738543 0.79 TAAR1 (0.52)
SCHEMBL4534365 0.78 ALDH1A1 (0.43) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL13682551 0.78 ALDH1A1 (0.52) GABRG2GABRB3GABRA5GABRA3NPC1
SCHEMBL3353844 0.78 ESR2 (0.33) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL16154616 0.76 ABL1 (0.38) NPC1RAB9ASMN1; SMN2CYP1A2TP53
SCHEMBL15737457 0.76 MAOB (0.49) SMN1; SMN2KDM4EGAANPSR1ALDH1A1

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 1 patent. 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