SCHEMBL24747678

SCHEMBL24747678

c1ccc(-c2ccc(-c3cccc4ccccc34)cc2N(c2ccccc2)c2ccc3c(c2)sc2ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.40
▸ MCL1 Q07820 1/20 0.38
▸ ACMSD Q8TDX5 1/20 0.38
▸ ALOX5 P09917 1/20 0.35
▸ CA12 O43570 3/20 0.34
▸ CA1 P00915 3/20 0.34
▸ CA2 P00918 3/20 0.34
▸ CA9 Q16790 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ S1PR5 Q9H228 4/20 0.33
▸ S1PR4 O95977 3/20 0.33
▸ SLC9A1 P19634 1/20 0.32
▸ ABCB1 P08183 1/20 0.32
▸ PPARG P37231 2/20 0.32
▸ PPARA Q07869 2/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32

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
SCHEMBL24748869 0.99 F9 (0.41) F9MCL1ACMSDALOX5CA12
SCHEMBL24748823 0.98 F9 (0.40) F9MCL1ACMSDALOX5CA12
SCHEMBL24748859 0.98 F9 (0.40) F9MCL1ACMSDALOX5CA12
SCHEMBL24748828 0.96 F9 (0.39) F9MCL1ACMSDALOX5CA12
SCHEMBL24749683 0.94 F9 (0.39) F9MCL1ACMSDALOX5CA12
SCHEMBL24748173 0.94 F9 (0.37) F9MCL1ACMSDALOX5CA12
SCHEMBL24749660 0.94 ALOX5 (0.45) F9MCL1ACMSDALOX5CA12
SCHEMBL24748858 0.94 F9 (0.37) F9MCL1ACMSDALOX5CA12
SCHEMBL24748861 0.93 F9 (0.40) F9MCL1ACMSDALOX5CA12
SCHEMBL24747609 0.93 MCL1 (0.38) F9MCL1ACMSDALOX5CA12

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-2022259886-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE 出光興産株式会社 2022-12-15 — — WO disclosed
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