SCHEMBL31661387

SCHEMBL31661387

CN(C)Cc1ccc2c(c1)c1ncc(C#N)c(Cl)c1n2CC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MELK Q14680 1/20 0.35
METAP2 P50579 4/20 0.34
SRC P12931 9/20 0.32
CAMK2D Q13557 1/20 0.32
LYN P07948 3/20 0.31
PRKCQ Q04759 3/20 0.31
PRKCD Q05655 3/20 0.31
PRKCB P05771 1/20 0.31
LCK P06239 1/20 0.31
PRKCH P24723 1/20 0.31
PRKCE Q02156 1/20 0.31
PGR P06401 1/20 0.31
AR P10275 1/20 0.31

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
SCHEMBL31661374 0.84 CHKA (0.41) SRCPRKCQPRKCD
SCHEMBL31661349 0.83 METAP2 (0.36) METAP2SRCPGRAR
SCHEMBL31661339 0.82 CAMK2D (0.37) MELKMETAP2CAMK2D
SCHEMBL31661388 0.81 CAMK2D (0.42) MELKMETAP2CAMK2D
SCHEMBL31661341 0.81 HTR6 (0.37) METAP2SRCAR
SCHEMBL31661369 0.80 PTGER4 (0.37) METAP2
SCHEMBL30961799 0.79 CAMK2D (0.33) CAMK2D
SCHEMBL31661381 0.79 KCNH2 (0.33) METAP2
SCHEMBL31661359 0.77 METAP2 (0.35) METAP2
SCHEMBL30961807 0.76 CAMK2D (0.33) METAP2CAMK2D

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-2025151549-A1 PYRIDO[3,2-B]INDOLE-3-CARBONITRILE COMPOUNDS AND COMPOSITION FOR TARGETING TP53-Y220C MUTANTS FLARE THERAPEUTICS INC. (US) 2025-07-17 WO disclosed