SCHEMBL13796799

SCHEMBL13796799

O=S(=O)(NC[C@H]1CC[C@H](CNc2nc(Nc3ccc(Cl)cc3)c3ccccc3n2)CC1)c1ccc(Br)cc1OC(F)(F)F

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 15/20 0.73
▸ NPY5R Q15761 15/20 0.73
▸ ADRA2A P08913 14/20 0.73
▸ SOS1 Q07889 1/20 0.47
▸ AQP1 P29972 1/20 0.46
▸ CNR1 P21554 1/20 0.46
▸ CNR2 P34972 1/20 0.46

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
SCHEMBL13796409 0.95 MCHR1 (0.79) MCHR1NPY5RADRA2AAQP1CNR1
SCHEMBL13795555 0.91 MCHR1 (0.71) MCHR1NPY5RADRA2AAQP1CNR1
SCHEMBL13796801 0.90 MCHR1 (0.73) MCHR1NPY5RADRA2AAQP1CNR1
SCHEMBL13796992 0.88 MCHR1 (0.82) MCHR1NPY5RADRA2AAQP1
SCHEMBL13795799 0.88 MCHR1 (0.80) MCHR1NPY5RADRA2AAQP1
SCHEMBL13795902 0.88 MCHR1 (0.80) MCHR1NPY5RADRA2AAQP1
SCHEMBL13795908 0.87 MCHR1 (0.70) MCHR1NPY5RADRA2AAQP1CNR1
Hydrochloric Acid SCHEMBL3939624 0.87 MCHR1 (0.79) MCHR1NPY5RADRA2AAQP1
Hydrochloric Acid SCHEMBL3939621 0.87 MCHR1 (0.79) MCHR1NPY5RADRA2AAQP1
SCHEMBL14606992 0.87 MCHR1 (0.79) MCHR1NPY5RADRA2AAQP1

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-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
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