SCHEMBL22813041

SCHEMBL22813041

C1=C(c2cccc(-c3cccc4c3sc3ccccc34)c2)C=C(n2c3ccccc3c3ccccc32)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.44
▸ PRKDC P78527 5/20 0.37
▸ PIK3CD O00329 2/20 0.33
▸ PIK3CB P42338 2/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ BRDT Q58F21 1/20 0.33
▸ PARP14 Q460N5 1/20 0.32
▸ DNPH1 O43598 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
SCHEMBL29319333 0.82 ALOX5 (0.49) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL21226547 0.77 ALOX5 (0.46) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL1687809 0.76 ALOX5 (0.52) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL1687711 0.76 ALOX5 (0.52) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL1687803 0.76 ALOX5 (0.52) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL21152357 0.75 ALOX5 (0.55) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL22197601 0.75 ALOX5 (0.51) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL12996613 0.75 ALOX5 (0.51) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL17358427 0.75 ALOX5 (0.54) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL18381746 0.75 ALOX5 (0.51) ALOX5PRKDCPIK3CDPIK3CBBRD4

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
EP-3321258-B1 4-PHENYLBENZO[G]QUINAZOLINE OR 4-(3,5-DIMETHYLPHENYLBENZO[G]QUINAZOLINE IRIDIUM COMPLEXES FOR USE AS NEAR-INFRARED OR INFRARED EMITTING MATERIALS IN OLEDS UNIVERSAL DISPLAY CORP (US) 2020-12-23 — — EP disclosed
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