SCHEMBL13601376

SCHEMBL13601376

CCCc1cc(C(C)(O)C(F)(F)F)cc(CCC)c1Oc1cccc(CN2C(=O)NC(C)(c3ccc(OC(C)C)cc3)C2=O)c1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.77
NR1H3 Q13133 15/20 0.77

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
SCHEMBL1092455 0.94 NR1H2 (0.86) NR1H2NR1H3
SCHEMBL1093158 0.87 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL1093349 0.85 NR1H2 (0.81) NR1H2NR1H3
SCHEMBL1092453 0.83 NR1H2 (0.70) NR1H2NR1H3
SCHEMBL1101123 0.81 NR1H2 (0.70) NR1H2NR1H3
SCHEMBL1092778 0.81 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL1092873 0.79 NR1H2 (0.85) NR1H2NR1H3
SCHEMBL1091742 0.79 NR1H2 (0.83) NR1H2NR1H3
SCHEMBL1104470 0.79 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL1092488 0.79 NR1H2 (0.85) NR1H2NR1H3

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-2009144961-A1 SUBSTITUTED CARBINOL COMPOUND HAVING CYCLIC LINKER 興和株式会社 (JP) 2009-12-03 WO disclosed