SCHEMBL23255307

SCHEMBL23255307

Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1ccncc1-c1cc(C(F)(F)F)ccc1-n1c2ccccc2c2cc(-c3ccccc3C)ccc21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.39
▸ GPBAR1 Q8TDU6 5/20 0.38
▸ TACR1 P25103 4/20 0.37
▸ KIF11 P52732 1/20 0.37
▸ CYP17A1 P05093 4/20 0.37
▸ CYP1A2 P05177 3/20 0.35
▸ METAP2 P50579 1/20 0.35
▸ ERBB2 P04626 1/20 0.35
▸ NR3C1 P04150 1/20 0.35
▸ PGR P06401 1/20 0.35
▸ PDE2A O00408 1/20 0.35
▸ PDE7A Q13946 1/20 0.35
▸ AR P10275 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
SCHEMBL23255414 0.94 PDE10A (0.38) PDE10AGPBAR1TACR1KIF11CYP17A1
SCHEMBL23255690 0.93 GPBAR1 (0.39) PDE10AGPBAR1TACR1KIF11CYP17A1
SCHEMBL23255314 0.89 KIF11 (0.38) PDE10ATACR1KIF11CYP17A1CYP1A2
SCHEMBL23255442 0.88 KIF11 (0.37) PDE10AGPBAR1KIF11METAP2
SCHEMBL23255430 0.87 KIF11 (0.42) PDE10AKIF11CYP1A2METAP2PDE2A
SCHEMBL18374378 0.87 AR (0.42) PDE10AKIF11CYP1A2ERBB2NR3C1
SCHEMBL23255308 0.87 ICMT (0.37) PDE10AKIF11CYP17A1ERBB2
SCHEMBL23255435 0.87 GPBAR1 (0.39) PDE10AGPBAR1TACR1KIF11CYP17A1
SCHEMBL23255677 0.86 KIF11 (0.40) PDE10AKIF11CYP17A1CYP1A2METAP2
SCHEMBL23255605 0.86 PDE10A (0.36) PDE10AKIF11CYP17A1CYP1A2METAP2

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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