SCHEMBL13844985

SCHEMBL13844985

Cc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 19/20 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
SCHEMBL13693234 0.88 PTGER1 (0.71) PTGER1
SCHEMBL4085182 0.88 PTGER1 (0.71) PTGER1
Hydrochloric Acid SCHEMBL4096288 0.87 PTGER1 (0.70) PTGER1
SCHEMBL4085476 0.85 PTGER1 (0.64) PTGER1
SCHEMBL4100674 0.85 PTGER1 (0.67) PTGER1
SCHEMBL4090618 0.84 PTGER1 (0.82) PTGER1
SCHEMBL4091455 0.84 PTGER1 (0.82) PTGER1
SCHEMBL4091616 0.84 PTGER1 (0.82) PTGER1
SCHEMBL4085947 0.83 PTGER1 (1.00) PTGER1
SCHEMBL2830044 0.83 PTGER1 (0.58) PTGER1

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
WO-2009056556-A1 SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-05-07 WO disclosed