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SCHEMBL16636399

SCHEMBL16636399

CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(N)=O

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 13/20 0.73
▸ IL23R Q5VWK5 1/20 0.62
▸ CXCL8 P10145 1/20 0.58
▸ OPRM1 P35372 3/20 0.58
▸ MC4R P32245 1/20 0.58
▸ MC5R P33032 1/20 0.58
▸ MC3R P41968 1/20 0.58
▸ MC1R Q01726 1/20 0.58
▸ OPRK1 P41145 2/20 0.58

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
Venorphin SCHEMBL30516272 0.92 OPRM1 (0.67) KISS1RIL23ROPRM1OPRK1
SCHEMBL31238557 0.90 KISS1R (0.63) KISS1RCXCL8OPRM1OPRK1
SCHEMBL14479443 0.90 KISS1R (0.74) KISS1RIL23R
SCHEMBL11099432 0.90 KISS1R (0.63) KISS1RCXCL8OPRM1MC4RMC5R
SCHEMBL30716436 0.89 KISS1R (0.63) KISS1RIL23ROPRM1
SCHEMBL30608444 0.89 KISS1R (0.61) KISS1RCXCL8OPRM1OPRK1
SCHEMBL31238564 0.88 KISS1R (0.62) KISS1ROPRM1OPRK1
SCHEMBL13874905 0.88 KISS1R (0.80) KISS1R
SCHEMBL31273381 0.88 KISS1R (0.61) KISS1RCXCL8OPRM1OPRK1
SCHEMBL13144891 0.88 KISS1R (0.58) KISS1RIL23RCXCL8MC4RMC5R

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
EP-3054770-B1 NOVEL NEUROPEPTIDES USEFUL AS INSECTICIDES THE STATE OF ISRAEL MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT AGRICULTURAL RES ORGANIZATION ARO VO (IL) 2018-11-07 — — EP disclosed
US-9951110-B2 Neuropeptides useful as insecticides The State of Israel Agriculture Research Org (IL) 2018-04-24 — — US disclosed
US-20160355556-A1 NOVEL NEUROPEPTIDES USEFUL AS INSECTICIDES THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO), (VOLCANI CENTER) (IL) 2016-12-08 — — US disclosed
EP-3054770-A1 NOVEL NEUROPEPTIDES USEFUL AS INSECTICIDES The Volcani Center - The State of Israel, Ministry Of Agriculture, Agricultural Research Organization (IL) 2016-08-17 — — EP disclosed
WO-2015052701-A1 NOVEL NEUROPEPTIDES USEFUL AS INSECTICIDES THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO), (VOLCANI CENTER) (IL) 2015-04-16 — — WO disclosed