SCHEMBL8216333

SCHEMBL8216333

CCN(C)C(=O)C1(c2ccccc2)CCN(CCC(O)c2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.67
KCNA3 P22001 1/20 0.55
OPRL1 P41146 1/20 0.45
OPRD1 P41143 2/20 0.44
OPRK1 P41145 2/20 0.44
HTR1A P08908 1/20 0.44

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
SCHEMBL8188731 0.83 KCNA3 (0.58) KCNA3OPRL1HTR1A
SCHEMBL8216361 0.81 KCNA3 (0.56) KCNA3OPRL1HTR1A
Phenoperidine SCHEMBL80415 0.81 KCNA3 (0.83) OPRM1KCNA3OPRD1OPRK1
Sameridine SCHEMBL419071 0.81 OPRM1 (1.00) OPRM1KCNA3OPRD1OPRK1
Phenoperidine SCHEMBL394330 0.80 KCNA3 (0.81) OPRM1KCNA3OPRD1OPRK1
Phenoperidine SCHEMBL1652634 0.79 KCNA3 (0.80) OPRM1KCNA3OPRD1OPRK1
SCHEMBL8195038 0.78 OPRM1 (0.50) OPRM1KCNA3OPRD1OPRK1
SCHEMBL8187800 0.76 OPRM1 (0.65) OPRM1KCNA3OPRD1OPRK1
SCHEMBL11716765 0.74 OPRL1 (0.78) OPRM1OPRL1OPRD1OPRK1
Phenoperidine SCHEMBL28832646 0.72 KCNA3 (0.67) OPRM1KCNA3OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1067989-C Novel compounds with analgesic and local anaesthetic effect ASTRA AB (SE) 2001-07-04 CN disclosed
EP-0743940-B1 NEW COMPOUNDS WITH ANALGESIC AND LOCAL ANAESTHETIC EFFECT ASTRA AB (SE) 2000-05-03 EP disclosed
US-5968953-A FOR SIDE EFFECT REDUCTION ASTRA AB (SE) 1999-10-19 US disclosed
US-5756520-A N-SUBSTITUTED 4-PHENYL-4-CARBOXAMIDE-PIPERIDINE COMPOUNDS ARE ADMINISTERED EPIDURALLY OR INTRATHECALLY FOR CONTROLLING NERVE BLOCKADE IN HUMANS ASTRA AB (SE) 1998-05-26 US disclosed
CN-1140448-A New compounds with analgesic and local anaesthetic effect ASTRA AB (SE) 1997-01-15 CN disclosed
EP-0743940-A1 NEW COMPOUNDS WITH ANALGESIC AND LOCAL ANAESTHETIC EFFECT Astra Aktiebolag (SE) 1996-11-27 EP disclosed
WO-1995021821-A1 NEW COMPOUNDS WITH ANALGESIC AND LOCAL ANAESTHETIC EFFECT ASTRA AKTIEBOLAG (SE) 1995-08-17 WO disclosed