SCHEMBL8432968

SCHEMBL8432968

CC(N)C(=O)NC(Cc1ccccc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCC(=O)NC(C(=O)NC(CO)C(=O)O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 14/20 0.59
▸ OPRM1 P35372 10/20 0.59
▸ OPRK1 P41145 2/20 0.55

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
SCHEMBL8432975 1.00 OPRD1 (0.59) OPRD1OPRM1OPRK1
SCHEMBL29994509 0.88 OPRD1 (0.56) OPRD1OPRM1OPRK1
SCHEMBL30255433 0.85 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL29789548 0.85 CTSB (0.53) OPRD1OPRM1OPRK1
SCHEMBL29599396 0.85 OPRD1 (0.62) OPRD1OPRM1OPRK1
SCHEMBL30628801 0.85 OPRD1 (0.70) OPRD1OPRM1OPRK1
SCHEMBL30628807 0.85 OPRD1 (0.70) OPRD1OPRM1OPRK1
SCHEMBL29695650 0.85 OPRD1 (0.64) OPRD1OPRM1OPRK1
SCHEMBL31441080 0.84 MME (0.58) OPRD1OPRM1
SCHEMBL29591236 0.84 MME (0.55) —

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
US-5861255-A PERFORMING POLYMERASE CHAIN REACTION OF DNA USING PRIMER OLIGONUCLEOTIDES, ANNEALING AND TREATMENT WITH ACTINOBACILLUS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1999-01-19 — — US disclosed
US-5726016-A Compositions and methods for diagnosis of diseases associated with actinobacillus actinomycetemcomitans infection THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1998-03-10 — — US disclosed
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