SCHEMBL5370735

SCHEMBL5370735

CCN1C(=O)OC[C@@H]1Cc1ccc(Oc2ccc(N(c3ccc(C(F)(F)F)cn3)c3ccccc3C)cc2F)cc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 2/20 0.34
MGLL Q99685 1/20 0.31
SCN9A Q15858 1/20 0.30
PIK3CA P42336 2/20 0.30
MTOR P42345 2/20 0.30
POLQ O75417 1/20 0.30

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
SCHEMBL4506374 0.87 SCN9A (0.33) LIPEMGLLSCN9APOLQ
SCHEMBL5329457 0.87 SCN9A (0.33) LIPEMGLLSCN9APOLQ
SCHEMBL4507020 0.87 RXRA (0.33) LIPEMGLLSCN9APOLQ
SCHEMBL5317212 0.87 RXRA (0.33) LIPEMGLLSCN9APOLQ
SCHEMBL4524286 0.80 HTR1D (0.35) LIPEMGLLSCN9APOLQ
SCHEMBL5329788 0.80 HTR1D (0.35) LIPEMGLLSCN9APOLQ
SCHEMBL4508563 0.78 SCN9A (0.36) LIPESCN9A
SCHEMBL4232544 0.77 SCN9A (0.32) MGLLSCN9APOLQ
SCHEMBL5334219 0.76 PPARG (0.34) SCN9APIK3CAMTOR
SCHEMBL4506610 0.76 PPARG (0.34) SCN9APIK3CAMTOR

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-2007029062-A2 NOVEL PYRIDINE DERIVATIVES ORCHID RESEARCH LABORATORIES LIMITED (IN) 2007-03-15 WO claimed