SCHEMBL17033760

SCHEMBL17033760

c1ccc2c(c1)sc1c(-n3c4ccccc4c4ccc5c(cc6c7ccccc7c7ccccc7n65)c43)cccc12

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
GPR3 P46089 1/20 0.32
MAPT P10636 3/20 0.31
ALDH1A1 P00352 2/20 0.31
RAB9A P51151 2/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
PRKDC P78527 1/20 0.30
KDM4E B2RXH2 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL17033854 0.86 ALOX5 (0.35) ALOX5GPR3ALDH1A1TNKSTNKS2
SCHEMBL17033638 0.85 TNKS (0.32) ALOX5GPR3MAPTALDH1A1RAB9A
SCHEMBL18086148 0.85 GPR3 (0.41) ALOX5GPR3MAPTALDH1A1RAB9A
SCHEMBL20070547 0.84 GPR3 (0.31) ALOX5GPR3MAPTALDH1A1HPGD
SCHEMBL17033521 0.84 ALOX5 (0.35) ALOX5GPR3MAPTALDH1A1TNKS
SCHEMBL17246419 0.84 GPR3 (0.39) ALOX5GPR3MAPTALDH1A1RAB9A
SCHEMBL17206537 0.83 GPR3 (0.36) ALOX5GPR3MAPTALDH1A1RAB9A
SCHEMBL18381843 0.82 GPR3 (0.43) ALOX5GPR3MAPTALDH1A1RAB9A
SCHEMBL15073806 0.82 ATM (0.46) ALOX5GPR3MAPTALDH1A1TNKS
SCHEMBL21671076 0.81 GPR3 (0.39) ALOX5GPR3MAPTALDH1A1RAB9A

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
WO-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed