SCHEMBL7994344

SCHEMBL7994344

C=CCN1C[C@H](C)N([C@@H](c2ccc(S(=O)(=O)N(C)C)cc2)c2cccc(O)c2)C[C@H]1C

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.68
CYP1A2 P05177 1/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2C9 P11712 1/20 0.68
HPGD P15428 1/20 0.68
OPRM1 P35372 1/20 0.68
OPRK1 P41145 1/20 0.68
SIGMAR1 Q99720 1/20 0.68

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
SCHEMBL4575679 1.00 OPRD1 (0.68) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL4575840 1.00 OPRD1 (0.68) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL6374535 1.00 OPRD1 (0.68) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL4575933 1.00 OPRD1 (0.68) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL4576016 1.00 OPRD1 (0.68) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL7923037 1.00 OPRD1 (0.68) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL13440481 0.94 OPRD1 (0.64) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL6933103 0.92 OPRD1 (0.67) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL6933099 0.92 OPRD1 (0.67) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL6933102 0.92 OPRD1 (0.67) OPRD1CYP1A2CYP3A4CYP2C9HPGD

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-1003373-A4 COMPOSITIONS AND METHODS FOR REDUCING RESPIRATORY DEPRESSION AND ATTENDANT SIDE EFFECTS OF MU OPIOID COMPOUNDS DELTA PHARMACEUTICALS INC (US) 2000-09-20 EP disclosed
EP-1003373-A1 COMPOSITIONS AND METHODS FOR REDUCING RESPIRATORY DEPRESSION AND ATTENDANT SIDE EFFECTS OF MU OPIOID COMPOUNDS DELTA PHARMACEUTICALS, INC. (US) 2000-05-31 EP disclosed
WO-2000009508-A1 TRIAZOLOPYRIMIDINE DERIVATIVES NIHON BAYER AGROCHEM K.K. (DE) 2000-02-24 WO disclosed
US-5985880-A REDUCING, TREATING OR PREVENTING DRUG-MEDIATED RESPIRATORY DEPRESSION IN AN ANIMAL BY ADMINISTERING A .DELTA. RECEPTOR AGONIST COMPOUND DELTA PHARMACEUTICALS (US) 1999-11-16 US disclosed
WO-1999001033-A1 COMPOSITIONS AND METHODS FOR REDUCING RESPIRATORY DEPRESSION AND ATTENDANT SIDE EFFECTS OF MU OPIOID COMPOUNDS DELTA PHARMACEUTICALS, INC. (US) 1999-01-14 WO disclosed