SCHEMBL14137775

SCHEMBL14137775

CCCc1cc2cc(C)ccc2nc1C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRM1 Q13255 3/20 0.48
▸ PSMB5 P28074 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ CYP1A2 P05177 1/20 0.44
▸ PDE10A Q9Y233 4/20 0.42
▸ NCK1 P16333 1/20 0.42
▸ BACE1 P56817 1/20 0.42
▸ MAPT P10636 3/20 0.41
▸ PKM P14618 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.39

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
SCHEMBL13597686 0.85 MEN1 (0.54) GRM1PSMB5MEN1KMT2ACYP1A2
SCHEMBL12570780 0.73 CYP1A2 (0.55) GRM1PSMB5MEN1KMT2ACYP1A2
SCHEMBL862359 0.72 MEN1 (0.56) PSMB5MEN1KMT2ACYP1A2NCK1
SCHEMBL1537768 0.72 CYP2A6 (0.61) CYP1A2MAPTKDM4E
SCHEMBL12000236 0.71 MAPT (0.58) GRM1MEN1KMT2ACYP1A2MAPT
SCHEMBL2371400 0.71 CYP1A2 (0.62) PSMB5MEN1KMT2ACYP1A2NCK1
SCHEMBL22296337 0.70 ALDH1A1 (0.54) GRM1MEN1KMT2ACYP1A2MAPT
SCHEMBL19255198 0.70 CYP1A2 (0.43) PSMB5MEN1KMT2ACYP1A2PDE10A
SCHEMBL12677805 0.70 ALDH1A1 (0.54) GRM1MEN1KMT2AKDM4E
SCHEMBL8177959 0.69 ALDH1A1 (0.62) PSMB5MEN1KMT2ACYP1A2NCK1

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-1332133-B1 METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2008-07-09 — — EP disclosed
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