SCHEMBL7351702

SCHEMBL7351702

N=C(N)NCCCCCCCC(=O)NC(CCC(=O)O)NC(=O)CCCCCCCNC(=N)N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.43
PLA2G2C Q5R387 1/20 0.42
PRMT1 Q99873 1/20 0.42
ITGB3 P05106 4/20 0.40
ITGA2B P08514 4/20 0.40
ADRA1A P35348 1/20 0.40
NPY4R P50391 2/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
NPY5R Q15761 1/20 0.39
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EPHX2 P34913 3/20 0.38
NOD1 Q9Y239 1/20 0.37
TYMS P04818 1/20 0.37
GART P22102 1/20 0.37
ATIC P31939 1/20 0.37
FNTA P49354 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
SCHEMBL7348675 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7349426 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7353580 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7348479 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7355782 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7347873 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7349234 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7350352 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL7349462 0.87 EPHX2 (0.41) PRMT1ITGB3ITGA2BADRA1ANPY4R
SCHEMBL22198637 0.86 NPY4R (0.46) PLA2G10PLA2G2CNPY4RNPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5258398-A Anticoagulants; platelet aggregation inhibitors RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1993-11-02 US claimed
WO-1993011759-A1 ANTITHROMBOTIC DIAMINOALKANOIC ACID DERIVATIVES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1993-06-24 WO claimed
US-5258398-A Anticoagulants; platelet aggregation inhibitors RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1993-11-02 US disclosed
WO-1993011759-A1 ANTITHROMBOTIC DIAMINOALKANOIC ACID DERIVATIVES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1993-06-24 WO disclosed