SCHEMBL24929623

SCHEMBL24929623

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3cccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)c6c5sc5ccccc56)c34)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.36
ALOX5 P09917 2/20 0.35
PRKDC P78527 2/20 0.33
CHEK2 O96017 1/20 0.31
BRDT Q58F21 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PLA2G10 O15496 1/20 0.30
PLA2G2A P14555 1/20 0.30
PLA2G4A P47712 1/20 0.30
PIK3CD O00329 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
SCHEMBL24928181 0.95 ALOX5 (0.38) LIMK1ALOX5PRKDCCHEK2BRDT
SCHEMBL24928187 0.91 ALOX5 (0.41) LIMK1ALOX5PRKDCCHEK2PIK3CD
SCHEMBL24929011 0.91 ALOX5 (0.36) LIMK1ALOX5PRKDCCHEK2KDM4E
SCHEMBL24929416 0.90 LIMK1 (0.36) LIMK1ALOX5PRKDCCHEK2BRDT
SCHEMBL22329920 0.90 LIMK1 (0.36) LIMK1ALOX5PRKDCCHEK2HSP90AA1
SCHEMBL24929499 0.90 ALOX5 (0.33) LIMK1ALOX5PRKDCCHEK2BRDT
SCHEMBL24929385 0.90 LIMK1 (0.38) LIMK1ALOX5PRKDCBRDTKDM4E
SCHEMBL24929930 0.89 PRKDC (0.42) LIMK1ALOX5PRKDCBRDTKDM4E
SCHEMBL24928178 0.89 PRKDC (0.42) LIMK1ALOX5PRKDCBRDTPIK3CD
SCHEMBL24929010 0.89 ALOX5 (0.40) LIMK1ALOX5PRKDCBRDTKDM4E

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
WO-2023008795-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-02-02 WO disclosed