SCHEMBL19986003

SCHEMBL19986003

c1cc(-c2ccc3sc4ccccc4c3c2)cc(-n2c3ccccc3c3c4c5ccccc5c5ccccc5c4c4c5ccccc5sc4c32)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TP53 P04637 1/20 0.33
ALOX5 P09917 1/20 0.33
LIMK1 P53667 1/20 0.31
GPR3 P46089 1/20 0.31
PIM3 Q86V86 1/20 0.31
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 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
SCHEMBL19985987 0.93 MAPT (0.34) MAPTRXFP1TP53ALOX5LIMK1
SCHEMBL19985932 0.93 MAPT (0.35) MAPTRXFP1TP53ALOX5LIMK1
SCHEMBL19985920 0.92 MAPT (0.36) MAPTRXFP1TP53ALOX5LIMK1
SCHEMBL19986004 0.91 GPR3 (0.33) MAPTTP53ALOX5LIMK1GPR3
SCHEMBL19985937 0.91 MAPT (0.37) MAPTRXFP1TP53ALOX5LIMK1
SCHEMBL19985938 0.90 MAPT (0.36) MAPTRXFP1TP53LIMK1TNKS
SCHEMBL19985941 0.89 KDM4E (0.38) MAPTRXFP1TP53LIMK1
SCHEMBL19985923 0.89 MAPT (0.33) MAPTRXFP1TP53
SCHEMBL26476578 0.89 MAPT (0.35) MAPTRXFP1TP53ALOX5LIMK1
SCHEMBL19985960 0.88 GPR3 (0.36) MAPTRXFP1TP53GPR3TNKS

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-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed