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SCHEMBL22562380

SCHEMBL22562380

Cc1cc(C)c(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3cccc(-c4ccccc4)n3)cc(-n3c4ccccc4c4cc(-c5c(C)cc(C)cc5C)ccc43)c2C(F)(F)F)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 3/20 0.35
▸ MEN1 O00255 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MAPT P10636 4/20 0.32
▸ ENPP1 P22413 1/20 0.32
▸ GSK3B P49841 2/20 0.31
▸ MAP4K1 Q92918 1/20 0.31
▸ DHODH Q02127 2/20 0.31
▸ TP53 P04637 1/20 0.31
▸ PTGER4 P35408 2/20 0.30

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
SCHEMBL22562382 0.97 MEN1 (0.34) MEN1RAB9AKMT2AMAPTENPP1
SCHEMBL22562379 0.95 MAPT (0.31) NPY5RMEN1RAB9AKMT2AMAPT
SCHEMBL22562383 0.92 MEN1 (0.33) MEN1RAB9AKMT2AMAPTENPP1
SCHEMBL22562355 0.90 ENPP1 (0.37) NPY5RMEN1RAB9AKMT2AMAPT
SCHEMBL22562297 0.89 MAPT (0.34) NPY5RMEN1RAB9AKMT2AMAPT
SCHEMBL22562371 0.89 MEN1 (0.36) NPY5RMEN1RAB9AKMT2AMAPT
SCHEMBL22562303 0.89 MEN1 (0.36) MEN1RAB9AKMT2AMAPTENPP1
SCHEMBL22562360 0.88 PDK2 (0.36) NPY5RMEN1RAB9AKMT2AMAPT
SCHEMBL19942804 0.88 NPY5R (0.34) NPY5RENPP1PTGER4
SCHEMBL22562471 0.87 GSK3B (0.34) NPY5RMEN1RAB9AKMT2AMAPT

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-3418278-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 — — EP disclosed