SCHEMBL23255676

SCHEMBL23255676

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccncc1-c1cc(C(F)(F)F)ccc1-n1c2ccc(C)cc2c2cc(C)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.41
▸ KIF11 P52732 4/20 0.40
▸ PDE2A O00408 1/20 0.38
▸ PDE7A Q13946 1/20 0.38
▸ PIK3CA P42336 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ PIK3CG P48736 1/20 0.38
▸ PTGDR2 Q9Y5Y4 3/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ METAP2 P50579 1/20 0.37
▸ CHUK O15111 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.34
▸ GPBAR1 Q8TDU6 2/20 0.34
▸ ACHE P22303 1/20 0.34
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ ELANE P08246 1/20 0.34

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
SCHEMBL23255677 0.94 KIF11 (0.40) PDE10AKIF11PDE2APDE7APIK3CA
SCHEMBL23255294 0.93 PDE10A (0.39) PDE10AKIF11PDE2APDE7APIK3CA
SCHEMBL23255276 0.91 PDE10A (0.40) PDE10AKIF11PDE2APDE7APIK3CA
SCHEMBL23255439 0.89 CHUK (0.40) PDE10AKIF11PDE2APDE7ACYP1A2
SCHEMBL18374375 0.88 KIF11 (0.49) KIF11PIK3CAPIK3CBPIK3CGPTGDR2
SCHEMBL23255292 0.88 KIF11 (0.39) PDE10AKIF11PDE2APDE7APIK3CA
SCHEMBL19795556 0.87 KIF11 (0.47) KIF11PIK3CAPIK3CBPIK3CGPTGDR2
SCHEMBL17952916 0.87 ACHE (0.42) ACHEELANE
SCHEMBL23255277 0.86 KIF11 (0.40) PDE10AKIF11PDE2APDE7APIK3CA
SCHEMBL23255430 0.85 KIF11 (0.42) PDE10AKIF11PDE2APDE7ACYP1A2

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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