SCHEMBL6983486

SCHEMBL6983486

O=C(Cc1ccc(Cl)cc1Cl)N(O)[C@H](CN1CC[C@H](O)C1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 1/20 0.58
OPRK1 P41145 13/20 0.54
CYP2D6 P10635 6/20 0.54
OPRM1 P35372 5/20 0.52
OPRD1 P41143 5/20 0.52

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
SCHEMBL6983483 1.00 CCR5 (0.58) CCR5OPRK1CYP2D6OPRM1OPRD1
SCHEMBL8642848 1.00 CCR5 (0.58) CCR5OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6973690 0.92 OPRK1 (0.56) CCR5OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6973689 0.92 OPRK1 (0.56) CCR5OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6970851 0.90 CCR5 (0.56) CCR5OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6970856 0.90 CCR5 (0.56) CCR5OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6981940 0.90 OPRK1 (0.53) OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6981943 0.90 OPRK1 (0.53) OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6982138 0.89 OPRK1 (0.56) OPRK1CYP2D6OPRM1OPRD1
SCHEMBL6982131 0.89 OPRK1 (0.56) OPRK1CYP2D6OPRM1OPRD1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0817772-B1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER (US) 2003-01-29 EP claimed
US-5952369-A ANALGESIC, TREATMENT FOR STROKE OR ABDOMINAL PAIN ASSOCIATED WITH FUNCTIONAL BOWEL DISEASE PFIZER INC (US) 1999-09-14 US claimed
EP-0817772-A1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER INC. (US) 1998-01-14 EP claimed
WO-1996030339-A1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER INC. (US) 1996-10-03 WO claimed
EP-0817772-B1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER (US) 2003-01-29 EP disclosed
US-6110947-A AN ANALGESIC AGENT FOR TREATING STROKE, ABDOMINAL PAIN; AS ANTIINFLAMMATORY, DIURETIC, ANESTHETIC OR NEUROPROTECTIVE AGENTS PFIZER INC. (US) 2000-08-29 US disclosed
EP-0982297-A2 Process for the preparation of hydroxy-pyrrolidinyl hydroxamic acid derivatives being opioid kappa receptor agonists Pfizer Products Inc. (US) 2000-03-01 EP disclosed
US-6031114-A Process for pyrrolidinyl hydroxamic acid compounds PFIZER INC. (US) 2000-02-29 US disclosed
US-5952369-A ANALGESIC, TREATMENT FOR STROKE OR ABDOMINAL PAIN ASSOCIATED WITH FUNCTIONAL BOWEL DISEASE PFIZER INC (US) 1999-09-14 US disclosed
WO-1996030339-A1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER INC. (US) 1996-10-03 WO disclosed