SCHEMBL23255485

SCHEMBL23255485

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(C(F)(F)F)cc1-c1ncccc1-n1c2ccc(C)cc2c2cc(C)ccc21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 3/20 0.38
▸ KIF11 P52732 3/20 0.37
▸ IDO1 P14902 1/20 0.37
▸ PDE2A O00408 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.37
▸ PDK2 Q15119 1/20 0.37
▸ PIK3CA P42336 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ MAT2A P31153 3/20 0.35
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ TRPV1 Q8NER1 2/20 0.34
▸ AKT1 P31749 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.33
▸ AKR1A1 P14550 1/20 0.32
▸ AKR1B1 P15121 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
SCHEMBL23255483 0.96 KIF11 (0.39) PTGDR2KIF11IDO1PDE2APDE10A
SCHEMBL23255493 0.92 MAT2A (0.38) KIF11PDE2APDE10AMAT2ATRPV1
SCHEMBL23255297 0.89 KIF11 (0.36) KIF11PDE2APDE10AMAT2ATRPV1
SCHEMBL23255446 0.88 KIF11 (0.36) KIF11IDO1PDE2APDE10ATRPV1
SCHEMBL23255448 0.87 KIF11 (0.40) KIF11PDE2APDE10AMAT2AAKT1
SCHEMBL23255447 0.86 ICMT (0.36) KIF11MAT2ATRPV1AKT1
SCHEMBL23255484 0.85 KIF11 (0.40) KIF11PDE2APDE10AMAT2ATRPV1
SCHEMBL18374375 0.85 KIF11 (0.49) PTGDR2KIF11PIK3CAPIK3CBPIK3CG
SCHEMBL23255300 0.84 TOP1 (0.39) KIF11PDE2APDE10ATRPV1AKT1
SCHEMBL19795556 0.84 KIF11 (0.47) PTGDR2KIF11PIK3CAPIK3CBPIK3CG

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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