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SCHEMBL9149396

SCHEMBL9149396

CCC(C)C(NC(=O)C(CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)C(CS)NC(=O)C(CO)NC(=O)C(CO)NC(=O)C(N)CCCNC(=N)N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 5/20 0.49
▸ NPY1R P25929 4/20 0.49
▸ NPY2R P49146 4/20 0.49
▸ NPY5R Q15761 4/20 0.49
▸ OPRM1 P35372 3/20 0.49
▸ OPRD1 P41143 3/20 0.49
▸ QRFPR Q96P65 1/20 0.48
▸ OPRK1 P41145 1/20 0.48
▸ OPRL1 P41146 2/20 0.47

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
SCHEMBL9149411 1.00 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5ROPRM1
SCHEMBL31307267 0.88 OPRM1 (0.56) OPRM1OPRD1QRFPROPRK1OPRL1
SCHEMBL30543038 0.87 TFPI (0.54) —
SCHEMBL7467426 0.86 PTH1R (0.48) OPRL1
SCHEMBL7469236 0.86 IL23R (0.48) NPY4RNPY1RNPY2RNPY5ROPRL1
SCHEMBL31210211 0.85 OPRL1 (0.49) OPRM1OPRD1QRFPROPRK1OPRL1
SCHEMBL7265311 0.85 PTH1R (0.50) OPRL1
SCHEMBL29863205 0.85 OPRM1 (0.53) NPY4RNPY1RNPY2RNPY5ROPRM1
SCHEMBL7467806 0.85 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5ROPRM1
SCHEMBL30327467 0.85 PTH1R (0.52) —

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
JP-7170988-A — — None — — JP disclosed
JP-H07170988-A NUCLEIC ACID MOLECULE AND MICROORGANISM OR CELL CULTURE MODIFIED SO AS TO CONTAIN NUCLEIC ACID MOLECULE SCIOS NOVA INC 1995-07-11 — — JP disclosed
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