SCHEMBL2662864

SCHEMBL2662864

O=C(OCc1ccccc1)N1CCC(c2cc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)CC1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.60

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
SCHEMBL5726133 1.00 MAPK14 (0.60) MAPK14
SCHEMBL22589253 0.91 MAPK14 (0.48) MAPK14
SCHEMBL22589139 0.90 MAPK14 (0.48) MAPK14
SCHEMBL6950656 0.86 CYP2D6 (0.45)
SCHEMBL6952425 0.85 TRPC3 (0.48)
SCHEMBL3099127 0.84 SMN1; SMN2 (0.48)
SCHEMBL1376871 0.81 MAPK14 (0.69) MAPK14
SCHEMBL5725265 0.81 MAPK14 (0.74) MAPK14
SCHEMBL22589298 0.80 TRPC3 (0.51) MAPK14
SCHEMBL22589274 0.80 TRPC3 (0.51) MAPK14

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-5776954-A GLUCAGON ANTAGONISTS MERCK & CO., INC. (US) 1998-07-07 US disclosed
WO-1997016442-A1 SUBSTITUTED PYRIDYL PYRROLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK & CO., INC. (US) 1997-05-09 WO disclosed