SCHEMBL7065964

SCHEMBL7065964

CNC(=O)[CH]CCCC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
SOAT1 P35610 2/20 0.39
MEN1 O00255 1/20 0.39
FAAH O00519 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.32

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
SCHEMBL7695119 0.92 FAAH (0.50) CNR1SOAT1MEN1FAAHTP53
SCHEMBL7698631 0.92 FAAH (0.50) CNR1SOAT1MEN1FAAHTP53
SCHEMBL7699295 0.92 FAAH (0.50) CNR1SOAT1MEN1FAAHTP53
SCHEMBL3431085 0.89 SOAT1 (0.36) CNR1SOAT1MEN1FAAHTP53
SCHEMBL4758344 0.79 CNR1 (0.43) CNR1SOAT1MEN1FAAHTP53
SCHEMBL10771318 0.78 PAOX (0.38) MEN1CYP1A2CYP3A4KMT2ALMNA
SCHEMBL5203612 0.77
SCHEMBL20705080 0.76
SCHEMBL1416049 0.76 EP300 (0.42) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL5439400 0.74 CNR1 (0.41) CNR1SOAT1MEN1FAAHTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637550-B2 Heteroaryl diamide compounds useful as MMP-13 inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-28 US disclosed
EP-1404302-A1 PHARMACEUTICAL COMPOSITIONS OF ADSORBATES OF AMORPHOUS DRUG Pfizer Products Inc. (US) 2004-04-07 EP disclosed
EP-1401503-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A SOLID DISPERSION OF A POORLY-SOLUBLE DRUG IN A MATRIX AND A SOLUBILITY-ENHANCING POLYMER Pfizer Products Inc. (US) 2004-03-31 EP disclosed
WO-2003000294-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A SOLID DISPERSION OF A POORLY-SOLUBLE DRUG IN A MATRIX AND A SOLUBILITY-ENHANCING POLYMER PFIZER PRODUCTS INC. (US) 2003-01-03 WO disclosed
WO-2003000238-A1 PHARMACEUTICAL COMPOSITIONS OF ADSORBATES OF AMORPHOUS DRUG PFIZER PRODUCTS INC. (US) 2003-01-03 WO disclosed