SCHEMBL3837210

SCHEMBL3837210

CC(C)N(C)c1nc2ccc(NC(=O)c3ncn(-c4ccc(C(F)(F)F)cc4)n3)cc2[nH]1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 17/20 0.62
MAPT P10636 2/20 0.41
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL13818004 0.85 MCHR1 (0.61) MCHR1
SCHEMBL3837361 0.80 MCHR1 (0.69) MCHR1
SCHEMBL3832923 0.79 MCHR1 (0.61) MCHR1MAPT
SCHEMBL3833412 0.79 MCHR1 (0.65) MCHR1
SCHEMBL3835524 0.78 MCHR1 (0.64) MCHR1
SCHEMBL3831980 0.76 MCHR1 (0.67) MCHR1SMN1; SMN2
SCHEMBL3831493 0.76 MCHR1 (0.65) MCHR1
SCHEMBL3832854 0.76 MCHR1 (1.00) MCHR1
SCHEMBL13817984 0.74 MCHR1 (0.75) MCHR1
SCHEMBL13817971 0.73 MCHR1 (0.73) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1553089-B1 ANTAGONIST OF MELANIN-CONCENTRATING HORMONE RECEPTOR COMPRISING BENZIMIDAZOLE DERIVATIVE AS ACTIVE INGREDIENT BANYU PHARMA CO LTD (JP) 2009-09-30 EP claimed
US-7541477-B2 Antagonists to melanin-concentrating hormone receptor comprising benzimidazole derivative as active ingredient BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-06-02 US disclosed
US-7541477-B2 Antagonists to melanin-concentrating hormone receptor comprising benzimidazole derivative as active ingredient BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-06-02 US disclosed