SCHEMBL4433320

SCHEMBL4433320

NCCc1cc2cccc(Cl)c2nc1-c1ccccc1F

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.43
TAAR1 Q96RJ0 4/20 0.42
MAOB P27338 2/20 0.39
DPP4 P27487 2/20 0.38
MBNL1 Q9NR56 1/20 0.37

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
SCHEMBL4174252 0.91 PIK3CD (0.41) PIK3CDTAAR1DPP4MBNL1
SCHEMBL4175812 0.86 PIK3CD (0.42) PIK3CDDPP4MBNL1
SCHEMBL27781223 0.85 PIK3CD (0.41) PIK3CDDPP4MBNL1
SCHEMBL4171072 0.85 PIK3CD (0.42) PIK3CDMBNL1
SCHEMBL4441908 0.83 PIK3CD (0.45) PIK3CDTAAR1DPP4
SCHEMBL4178087 0.82 DPP4 (0.51) PIK3CDDPP4
SCHEMBL4442988 0.82 PIK3CD (0.63) PIK3CD
SCHEMBL13853095 0.79 PIK3CD (0.38) PIK3CDDPP4MBNL1
SCHEMBL21705922 0.78 DPP4 (0.36) PIK3CDDPP4
SCHEMBL16585320 0.78 PIK3CD (0.47) PIK3CDTAAR1DPP4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137186-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2009-12-30 EP disclosed
WO-2008118468-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2008-10-02 WO disclosed