SCHEMBL23255484

SCHEMBL23255484

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1ccc(C(F)(F)F)cc1-c1ncccc1-n1c2ccccc2c2cc(C(C)(C)C)ccc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 3/20 0.40
▸ HTR6 P50406 2/20 0.37
▸ HRH1 P35367 1/20 0.37
▸ PPARG P37231 2/20 0.35
▸ PPARA Q07869 1/20 0.35
▸ TRPV1 Q8NER1 3/20 0.34
▸ MAT2A P31153 3/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ GSK3A P49840 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33
▸ AKT1 P31749 2/20 0.32
▸ KDR P35968 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
SCHEMBL23255448 0.96 KIF11 (0.40) KIF11HTR6HRH1MAT2APDE2A
SCHEMBL23255297 0.96 KIF11 (0.36) KIF11HTR6HRH1PPARGTRPV1
SCHEMBL23255493 0.91 MAT2A (0.38) KIF11HTR6HRH1TRPV1MAT2A
SCHEMBL23255483 0.90 KIF11 (0.39) KIF11HTR6HRH1TRPV1MAT2A
SCHEMBL23255298 0.89 KIF11 (0.37) KIF11HTR6HRH1PPARGPPARA
SCHEMBL23255301 0.89 KIF11 (0.37) KIF11HTR6HRH1PPARGPPARA
SCHEMBL23255299 0.87 TOP1 (0.37) KIF11TRPV1PDE2APDE10AAKT1
SCHEMBL23255446 0.87 KIF11 (0.36) KIF11HTR6HRH1TRPV1PDE2A
SCHEMBL23255491 0.86 TRPV1 (0.38) KIF11HTR6HRH1TRPV1PDE2A
SCHEMBL21758231 0.85 KIF11 (0.34) KIF11HTR6HRH1TRPV1GSK3A

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
EP-3581570-B1 CARBAZOLE-PYRIDINE-TRIFLUOROMETHYLPHENYL DERIVATIVES AND RELATED COMPOUNDS FOR USE AS TADF LUMINESCENT EMITTERS IN OLEDS CYNORA GMBH (DE) 2021-04-21 — — EP disclosed
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