SCHEMBL23867356

SCHEMBL23867356

c1ccc2c(-c3ccc(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4oc4ccccc45)cc3)cccc2c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.37
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA9 Q16790 3/20 0.32
PRKDC P78527 1/20 0.31
MCL1 Q07820 1/20 0.31
ACMSD Q8TDX5 1/20 0.31
ENPP3 O14638 1/20 0.31
ENPP1 P22413 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
F9 P00740 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
SCHEMBL23238044 0.94 ALOX5 (0.37) ALOX5CA12CA1CA2CA9
SCHEMBL25536666 0.94 ALOX5 (0.35) ALOX5CA12CA1CA2CA9
SCHEMBL24965110 0.94 ALOX5 (0.39) ALOX5CA12CA1CA2CA9
SCHEMBL23867385 0.94 ALOX5 (0.37) ALOX5CA12CA1CA2CA9
SCHEMBL23224834 0.93 ALOX5 (0.37) ALOX5MCL1ACMSDKDM4EALDH1A1
SCHEMBL25882348 0.92 ALOX5 (0.35) ALOX5
SCHEMBL24963856 0.92 ALOX5 (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL23867416 0.92 ALOX5 (0.39) ALOX5PRKDCF9
SCHEMBL23313618 0.92 ALOX5 (0.35) ALOX5MCL1ACMSDF9
SCHEMBL24919413 0.91 ALOX5 (0.36) ALOX5CA12CA1CA2CA9

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-20210305509-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-09-30 US disclosed