SCHEMBL8330909

SCHEMBL8330909

CCOCC1Cc2ccccc2CN1Cc1c(CC)nn(-c2c(C)cc(C(O)(CC)CC)cc2C)c1CC

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.31
▸ OPRD1 P41143 2/20 0.31
▸ OPRK1 P41145 2/20 0.31

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
SCHEMBL8325824 0.93 OPRM1 (0.31) OPRM1OPRD1OPRK1
SCHEMBL8330433 0.93 OPRM1 (0.31) OPRM1OPRD1OPRK1
SCHEMBL8329122 0.90 OPRM1 (0.31) OPRM1OPRD1OPRK1
SCHEMBL8329702 0.89 OPRM1 (0.33) OPRM1OPRD1OPRK1
SCHEMBL8329932 0.89 OPRM1 (0.33) OPRM1OPRD1OPRK1
SCHEMBL8330873 0.89 OPRM1 (0.31) OPRM1OPRD1OPRK1
SCHEMBL8328769 0.89 OPRM1 (0.31) OPRM1OPRD1OPRK1
SCHEMBL8330493 0.89 — —
SCHEMBL8330582 0.89 — —
SCHEMBL8322746 0.88 OPRM1 (0.33) OPRM1OPRD1OPRK1

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-0764153-A1 SUBSTITUTED PYRAZOLES HAVING CORTICOTROPIN-RELEASING FACTOR (CRF) ANTAGONIST ACTIVITY PFIZER INC. (US) 1997-03-26 — — EP claimed
WO-1995033727-A1 SUBSTITUTED PYRAZOLES HAVING CORTICOTROPIN-RELEASING FACTOR (CRF) ANTAGONIST ACTIVITY PFIZER INC. (US) 1995-12-14 — — WO claimed
US-5968944-A TREATING STRESS AND ANXIETY RELATED DISORDERS PFIZER INC. (US) 1999-10-19 — — US disclosed
EP-0764153-A1 SUBSTITUTED PYRAZOLES HAVING CORTICOTROPIN-RELEASING FACTOR (CRF) ANTAGONIST ACTIVITY PFIZER INC. (US) 1997-03-26 — — EP disclosed
WO-1995033727-A1 SUBSTITUTED PYRAZOLES HAVING CORTICOTROPIN-RELEASING FACTOR (CRF) ANTAGONIST ACTIVITY PFIZER INC. (US) 1995-12-14 — — WO disclosed
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