SCHEMBL7290758

SCHEMBL7290758

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CN)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ OPRM1 P35372 3/20 0.46
▸ OPRK1 P41145 3/20 0.46
▸ MAPT P10636 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ LAP3 P28838 3/20 0.41
▸ FOLH1 Q04609 2/20 0.40
▸ GRN P28799 1/20 0.40
▸ SORT1 Q99523 1/20 0.40
▸ MME P08473 1/20 0.39

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
SCHEMBL7290743 1.00 OPRD1 (0.46) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL6367826 0.93 OPRM1 (0.44) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL6367814 0.93 OPRM1 (0.44) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL11127918 0.91 ALDH1A1 (0.49) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL29692448 0.89 REN (0.39) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL30964329 0.89 OPRD1 (0.44) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL30808873 0.89 ALDH1A1 (0.46) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL3873046 0.87 ALDH1A1 (0.45) OPRD1ALDH1A1OPRM1OPRK1MAPT
SCHEMBL10773882 0.87 MME (0.43) OPRD1OPRM1OPRK1MME
SCHEMBL30946331 0.87 MME (0.43) OPRD1OPRM1OPRK1MME

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
EP-0316769-A2 Disulfide bridged cyclic peptides containing a cgridri sequence useful in control of hypertension G.D. Searle & Co. (US) 1989-05-24 — — EP claimed
EP-0316769-A3 DISULFIDE BRIDGED CYCLIC PEPTIDES CONTAINING A CGRIDRI SEQUENCE USEFUL IN CONTROL OF HYPERTENSION G.D. Searle & Co. (US) 1990-07-18 — — EP disclosed
EP-0316769-A2 Disulfide bridged cyclic peptides containing a cgridri sequence useful in control of hypertension G.D. Searle & Co. (US) 1989-05-24 — — EP disclosed
EP-0316769-A2 Disulfide bridged cyclic peptides containing a cgridri sequence useful in control of hypertension G.D. Searle & Co. (US) 1989-05-24 — — EP disclosed
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