SCHEMBL4807271

SCHEMBL4807271

Cc1ccc(C(=O)Nc2ccccc2OCC(O)CN2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 12/20 0.67
PLD2 O14939 7/20 0.60
PLD1 Q13393 5/20 0.60
OPRM1 P35372 10/20 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
Hydrochloric Acid SCHEMBL4806574 0.93 OPRL1 (0.61) OPRL1PLD2PLD1OPRM1
SCHEMBL4806019 0.92 OPRL1 (0.63) OPRL1PLD2PLD1OPRM1
SCHEMBL4804373 0.92 PLD2 (0.60) OPRL1PLD2PLD1
SCHEMBL4806618 0.91 OPRL1 (0.62) OPRL1PLD2PLD1OPRM1
SCHEMBL4802544 0.89 OPRL1 (0.66) OPRL1PLD2PLD1OPRM1
Hydrochloric Acid SCHEMBL4798788 0.88 OPRL1 (0.65) OPRL1PLD2PLD1OPRM1
SCHEMBL4799829 0.86 OPRL1 (0.57) OPRL1PLD2PLD1OPRM1
SCHEMBL4805216 0.85 PLD2 (0.59) OPRL1PLD2PLD1OPRM1
SCHEMBL4806305 0.85 PLD2 (0.59) OPRL1PLD2PLD1
SCHEMBL4803367 0.84 SCN1A (0.66) OPRL1PLD2PLD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7388020-B2 Benzimidazol derivatives modulate chemokine receptors ASTRAZENECA AB (SE) 2008-06-17 US claimed
US-20040116435-A1 Benzimidazol derivatives modulate chemokine receptors ASTRAZENECA AB (SE) 2004-06-17 US claimed
EP-1373248-A1 BENZIMIDAZOL DERIVATIVES MODULATE CHEMOKINE RECEPTORS AstraZeneca AB (SE) 2004-01-02 EP claimed
WO-2002074763-A1 BENZIMIDAZOL DERIVATIVES MODULATE CHEMOKINE RECEPTORS ASTRAZENECA AB (SE) 2002-09-26 WO claimed
US-7388020-B2 Benzimidazol derivatives modulate chemokine receptors ASTRAZENECA AB (SE) 2008-06-17 US disclosed
US-20040116435-A1 Benzimidazol derivatives modulate chemokine receptors ASTRAZENECA AB (SE) 2004-06-17 US disclosed
EP-1373248-A1 BENZIMIDAZOL DERIVATIVES MODULATE CHEMOKINE RECEPTORS AstraZeneca AB (SE) 2004-01-02 EP disclosed
WO-2002074763-A9 BENZIMIDAZOL DERIVATIVES MODULATE CHEMOKINE RECEPTORS ASTRAZENECA AB (SE) 2002-10-24 WO disclosed
WO-2002074763-A1 BENZIMIDAZOL DERIVATIVES MODULATE CHEMOKINE RECEPTORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed