SCHEMBL24929416

SCHEMBL24929416

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3cccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)c6c5oc5ccccc56)c34)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.36
ALOX5 P09917 3/20 0.35
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
PIM1 P11309 1/20 0.33
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
PTPRF P10586 2/20 0.32
PTPN2 P17706 2/20 0.32
PTPN1 P18031 2/20 0.32
MAPT P10636 4/20 0.31
CHEK2 O96017 1/20 0.31
POLB P06746 2/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
PRKDC P78527 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
BRDT Q58F21 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
SCHEMBL24929665 0.91 ALOX5 (0.37) LIMK1ALOX5ALDH1A1HPGDPIM1
SCHEMBL26226361 0.91 LIMK1 (0.35) LIMK1ALOX5ALDH1A1HPGDPIM1
SCHEMBL26219947 0.91 LIMK1 (0.37) LIMK1ALOX5ALDH1A1HPGDPIM1
SCHEMBL26216392 0.91 LIMK1 (0.38) LIMK1ALOX5ALDH1A1HPGDMAPT
SCHEMBL24929421 0.90 ALOX5 (0.38) LIMK1ALOX5ALDH1A1HPGDPIM1
SCHEMBL24929623 0.90 LIMK1 (0.36) LIMK1ALOX5ALDH1A1HPGDMAPT
SCHEMBL22377023 0.90 BRDT (0.37) LIMK1ALOX5ALDH1A1HPGDPIM1
SCHEMBL26223135 0.90 LIMK1 (0.35) LIMK1ALOX5ALDH1A1HPGDPIM1
SCHEMBL25458074 0.90 LIMK1 (0.38) LIMK1ALOX5ALDH1A1HPGDMAPT
SCHEMBL24929424 0.90 ALOX5 (0.40) LIMK1ALOX5ALDH1A1HPGDMAPT

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