SCHEMBL13797216

SCHEMBL13797216

CNc1nc(NCc2ccc(NC(=O)c3cnc(-c4ccc(Cl)cc4)s3)cc2)nc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTNNB1 P35222 19/20 0.64
▸ TCF7L2 Q9NQB0 19/20 0.64
▸ PTPN1 P18031 1/20 0.49

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
SCHEMBL14606715 0.86 CTNNB1 (0.64) CTNNB1TCF7L2
SCHEMBL13797204 0.80 CTNNB1 (0.86) CTNNB1TCF7L2
SCHEMBL4181522 0.78 CTNNB1 (1.00) CTNNB1TCF7L2
SCHEMBL12789187 0.78 PTPN1 (0.70) PTPN1
SCHEMBL13797207 0.77 CTNNB1 (0.82) CTNNB1TCF7L2
SCHEMBL13797222 0.76 CTNNB1 (0.67) CTNNB1TCF7L2
SCHEMBL13797215 0.76 CTNNB1 (0.72) CTNNB1TCF7L2
SCHEMBL13797212 0.75 CTNNB1 (0.75) CTNNB1TCF7L2
SCHEMBL4175284 0.73 CTNNB1 (1.00) CTNNB1TCF7L2
SCHEMBL4175851 0.73 CTNNB1 (1.00) CTNNB1TCF7L2

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