SCHEMBL19985936

SCHEMBL19985936

c1cc(-c2cccc3oc4ccccc4c23)cc(-n2c3ccccc3c3c4c5ccccc5c5ccccc5c4c4c5ccccc5sc4c32)c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
MAPT P10636 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
PRKDC P78527 1/20 0.32
TP53 P04637 1/20 0.31

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
SCHEMBL22960404 0.95 PRKDC (0.34) ALOX5MAPTRXFP1PRKDCTP53
SCHEMBL19985944 0.90 ALOX5 (0.40) ALOX5MAPTRXFP1PRKDC
SCHEMBL23309008 0.90 PRKDC (0.33) ALOX5MAPTRXFP1PRKDC
SCHEMBL19985976 0.90 BACE1 (0.31) ALOX5PRKDC
SCHEMBL19985951 0.89 ALOX5 (0.35) ALOX5MAPTRXFP1TP53
SCHEMBL19991914 0.88 PRKDC (0.35) ALOX5PRKDC
SCHEMBL19985911 0.88 PRKDC (0.33) MAPTRXFP1PRKDCTP53
SCHEMBL19985934 0.88 MAPT (0.32) MAPTRXFP1TP53
SCHEMBL19985917 0.87 KDM4E (0.35) ALOX5MAPTRXFP1TP53
SCHEMBL19986006 0.86 ALOX5 (0.45) ALOX5MAPTRXFP1PRKDCTP53

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