SCHEMBL25974016

SCHEMBL25974016

c1ccc(-c2ccc3cc(-c4nc(-c5cc(-c6ccc7ccc8ccccc8c7c6)cc6oc7ccccc7c56)nc5c4sc4ccccc45)ccc3c2)cc1

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.31
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 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

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
SCHEMBL25974007 0.95 LIMK1 (0.31) LIMK1PIM1PIM3PIM2KMT2A
SCHEMBL25973918 0.95 LIMK1 (0.31) LIMK1PIM1PIM3PIM2KMT2A
SCHEMBL25974012 0.95 LIMK1 (0.32) LIMK1PIM1PIM3PIM2
SCHEMBL25973923 0.95 S1PR5 (0.31) KMT2AKDM4EALDH1A1MAPTHSD17B10
SCHEMBL24585568 0.94 S1PR5 (0.32) LIMK1ALDH1A1MAPT
SCHEMBL25973932 0.94 LIMK1 (0.31) LIMK1PIM1PIM3PIM2KMT2A
SCHEMBL25973928 0.94 LIMK1 (0.31) LIMK1PIM1PIM3PIM2
SCHEMBL25974013 0.94 LIMK1 (0.31) LIMK1PIM1PIM3PIM2
SCHEMBL25973911 0.94 LIMK1 (0.31) LIMK1PIM1PIM3PIM2KMT2A
SCHEMBL25973924 0.94 NPC1 (0.31)

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-2023149718-A1 ORGANIC LIGHT-EMITTING ELEMENT INCLUDING HETEROCYCLIC COMPOUND, COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING ELEMENT, AND METHOD FOR MANUFACTURING ORGANIC LIGHT-EMITTING ELEMENT 엘티소재주식회사 2023-08-10 WO disclosed