SCHEMBL8780738

SCHEMBL8780738

O=C(NCCCc1ncc[nH]1)c1ccc(Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 17/20 0.71

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
SCHEMBL7011089 0.87 NAMPT (0.65) NAMPT
SCHEMBL6646546 0.87 NAMPT (0.56) NAMPT
SCHEMBL17195780 0.84 NAMPT (1.00) NAMPT
SCHEMBL7004700 0.83 MAPT (0.57) NAMPT
SCHEMBL17184516 0.82 NAMPT (0.91) NAMPT
SCHEMBL17941988 0.82 NAMPT (0.81) NAMPT
SCHEMBL17195932 0.80 NAMPT (0.91) NAMPT
SCHEMBL17942055 0.79 NAMPT (1.00) NAMPT
SCHEMBL17942068 0.78 NAMPT (0.89) NAMPT
SCHEMBL17196203 0.78 NAMPT (0.83) NAMPT

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
EP-0797567-A1 NOVEL AMINO ACID DERIVATIVES WITH IMPROVED MULTI-DRUG RESISTANCE ACTIVITY Vertex Pharmaceuticals Incorporated (US) 1997-10-01 EP disclosed
WO-1996015101-A1 NOVEL AMINO ACID DERIVATIVES WITH IMPROVED MULTI-DRUG RESISTANCE ACTIVITY VERTEX PHARMACEUTICALS INCORPORATED (US) 1996-05-23 WO disclosed