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SCHEMBL18717030

SCHEMBL18717030

CC(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCC(=O)NCCCC(NC(=O)[C@H](C)NC(=O)CNC=O)C(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)NC(C)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.52
▸ KISS1R Q969F8 1/20 0.45
▸ NPY5R Q15761 4/20 0.45
▸ NPY1R P25929 3/20 0.45
▸ NPY4R P50391 3/20 0.45
▸ IL23R Q5VWK5 6/20 0.44
▸ OPRL1 P41146 4/20 0.43
▸ NPY2R P49146 1/20 0.42

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
SCHEMBL19473949 0.81 KISS1R (0.57) KISS1RIL23R
SCHEMBL24488479 0.80 NPY4R (0.51) KISS1RNPY5RNPY1RNPY4RNPY2R
SCHEMBL12285427 0.79 GNPAT (0.52) KISS1RNPY5RNPY1RNPY4RNPY2R
SCHEMBL2552629 0.79 GNPAT (0.52) KISS1RNPY5RNPY1RNPY4RNPY2R
SCHEMBL18716899 0.78 NPY5R (0.44) TFPIKISS1RNPY5RNPY1RNPY4R
SCHEMBL12035324 0.77 NPY4R (0.60) KISS1RNPY5RNPY1RNPY4RNPY2R
SCHEMBL21392371 0.76 TFPI (0.44) TFPINPY5RNPY1RNPY4RIL23R
SCHEMBL24488464 0.76 NPY4R (0.49) KISS1RNPY5RNPY1RNPY4RNPY2R
SCHEMBL21392441 0.76 QRFPR (0.40) KISS1RIL23R
SCHEMBL30924724 0.76 TFPI (0.54) TFPIKISS1RNPY5RNPY1RNPY4R

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-2440572-B1 LACTAM-BRIDGED MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDES PALATIN TECHNOLOGIES INC (US) 2017-04-05 — — EP disclosed
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