SCHEMBL7738144

SCHEMBL7738144

O=C(CN1CCC(n2c(=O)[nH]c3ccccc32)CC1)Nc1ccc(Cl)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 1/20 0.72
▸ OPRM1 P35372 12/20 0.67
▸ PLD2 O14939 4/20 0.64
▸ PLD1 Q13393 3/20 0.64
▸ OPRK1 P41145 2/20 0.58
▸ OPRL1 P41146 1/20 0.58
▸ ALDH1A1 P00352 2/20 0.55
▸ PMP22 Q01453 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ SLC22A2 O15244 1/20 0.55
▸ NR1I2 O75469 1/20 0.55
▸ GMNN O75496 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ GLA P06280 1/20 0.55
▸ ADRB2 P07550 1/20 0.55
▸ ADRB1 P08588 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ HTR1A P08908 1/20 0.55

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
SCHEMBL7736356 0.91 NPY5R (0.73) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL7735743 0.91 NPY5R (0.73) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL7735736 0.90 NPY5R (0.72) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL7734810 0.90 OPRM1 (0.78) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL7736005 0.88 NPY5R (0.69) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL8159806 0.88 NPY5R (0.69) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL8155283 0.87 NPY5R (0.68) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL7734850 0.87 NPY5R (0.68) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL7736020 0.87 NPY5R (0.70) NPY5ROPRM1PLD2PLD1OPRK1
SCHEMBL7735746 0.86 NPY5R (0.67) NPY5ROPRM1PLD2PLD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410792-B1 OBESITY DISEASES BAYER CORPORATION 2002-06-25 — — US claimed
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