SCHEMBL731360

SCHEMBL731360

CCC(SC1(c2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)CCCc2cc(C#N)ccc21)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.33
DRD4 P21917 2/20 0.33
OPRM1 P35372 2/20 0.33
DRD3 P35462 2/20 0.33
KDM1A O60341 1/20 0.32
SYK P43405 1/20 0.31
EP300 Q09472 1/20 0.31
CREBBP Q92793 1/20 0.31
SIRT2 Q8IXJ6 3/20 0.31
PGR P06401 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
SCHEMBL4045639 0.85 KDM1A (0.34) DRD2DRD4OPRM1DRD3KDM1A
SCHEMBL733341 0.84 KDM1A (0.35) DRD2DRD4OPRM1DRD3KDM1A
SCHEMBL731436 0.82 KDM1A (0.35) DRD2DRD4OPRM1DRD3KDM1A
SCHEMBL731083 0.81 DRD2 (0.33) DRD2DRD4OPRM1DRD3KDM1A
SCHEMBL733031 0.80 KDM1A (0.36) KDM1ASYKEP300CREBBPPGR
SCHEMBL733371 0.79 KDM1A (0.31) KDM1A
SCHEMBL731222 0.78 PGR (0.43) DRD2DRD4OPRM1DRD3KDM1A
SCHEMBL4445905 0.77 KDM1A (0.34) DRD2DRD4OPRM1DRD3KDM1A
SCHEMBL733454 0.76 KDM1A (0.39) DRD2DRD4OPRM1DRD3KDM1A
SCHEMBL731890 0.74 KDM1A (0.35) DRD2DRD4OPRM1DRD3KDM1A

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
US-8138179-B2 Spiro-imidazo compounds NOVARTIS AG (CH) 2012-03-20 US disclosed