SCHEMBL21166971

SCHEMBL21166971

Cn1c2cc(-c3cc4ccccc4s3)ccc2c(=O)c2cc3c(cc21)c(=O)c1ccc(-c2cc4ccccc4s2)cc1n3C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.46
ERN1 O75460 2/20 0.44
CA1 P00915 2/20 0.44
CA9 Q16790 2/20 0.44
CA2 P00918 1/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
ATM Q13315 2/20 0.43
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
CA12 O43570 1/20 0.41
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL20987492 0.92 APP (0.46) APPERN1CA1CA9CA2
SCHEMBL21167122 0.83 APP (0.39) APPERN1CA1CA9CA2
SCHEMBL20987497 0.77 RORA (0.41) APPERN1CA1CA9CA2
SCHEMBL21023296 0.77 PRKDC (0.43) APPCA1CA9CA2NPC1
SCHEMBL14302581 0.76 APP (0.54) APPERN1CA1CA9CA2
SCHEMBL21167110 0.75 MAOB (0.57) NPC1RAB9AL3MBTL1ATMPOLB
SCHEMBL21166974 0.73 ALOX5 (0.52) NPC1RAB9AL3MBTL1ATMPOLB
SCHEMBL13129267 0.72 APP (0.61) APPERN1CA1CA9CA2
SCHEMBL21166970 0.72 L3MBTL1 (0.63) NPC1RAB9AL3MBTL1ATMPOLB
SCHEMBL32677328 0.71 APP (0.81) APPERN1CA1CA9CA2

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-20190221745-A1 PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, OPTICAL SENSOR, AND COMPOUND FUJIFILM CORPORATION (JP) 2019-07-18 US disclosed