SCHEMBL10900400

SCHEMBL10900400

O=C(O)Cc1ccc(N2CCN(c3ccc(Cl)cc3)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 2/20 0.66
▸ ATM Q13315 1/20 0.66
▸ ME2 P23368 1/20 0.64
▸ ME1 P48163 1/20 0.64
▸ ME3 Q16798 1/20 0.64
▸ ITGB3 P05106 3/20 0.63
▸ ITGA2B P08514 3/20 0.63
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ MAPT P10636 3/20 0.58
▸ DRD4 P21917 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ AKR1C3 P42330 3/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ HPGD P15428 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ HTR1A P08908 1/20 0.51
▸ GRM5 P41594 1/20 0.51
▸ NSD2 O96028 1/20 0.50

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
SCHEMBL10901064 0.92 ITGB3 (0.70) GFERATMME2ME1ME3
SCHEMBL10900735 0.89 ADRA1D (0.59) GFERATMME2ME1ME3
SCHEMBL10901774 0.89 LMNA (0.70) GFERATMME2ME1ME3
SCHEMBL1065084 0.84 ITGB3 (0.64) ITGB3ITGA2BMEN1KMT2AMAPT
SCHEMBL2285282 0.84 ITGB3 (0.64) ME2ME1ME3ITGB3ITGA2B
SCHEMBL10897475 0.83 MEN1 (0.68) GFERATMME2ME1ME3
SCHEMBL10898228 0.83 MEN1 (0.60) GFERATMME2ME1ME3
SCHEMBL10900952 0.83 EBP (0.58) GFERATMME2ME1ME3
SCHEMBL10898221 0.83 MEN1 (0.60) GFERATMME2ME1ME3
SCHEMBL10900946 0.83 EBP (0.58) GFERATMME2ME1ME3

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
US-4616086-A ANTICOAGULANTS BOEHRINGER MANNHEIM GMBH (DE) 1986-10-07 — — US disclosed
EP-0076996-A1 Carboxylic-acid derivatives, process for their preparation and medicines containing them Roche Diagnostics GmbH (DE) 1983-04-20 — — EP disclosed
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