SCHEMBL16239554

SCHEMBL16239554

CC(Cc1ncc(O)cc1Cl)C(F)F

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL364169 0.83 HSD17B10 (0.37) ALOX15ALOX12ESR1ESR2TDP1
SCHEMBL27321635 0.75 HSD17B10 (0.37) ESR1TDP1L3MBTL1
SCHEMBL17057374 0.71 HSD17B10 (0.37) TDP1L3MBTL1
SCHEMBL15577467 0.68 HSD17B10 (0.34) TDP1L3MBTL1
SCHEMBL21786709 0.66 AGBL2 (0.38) TDP1L3MBTL1MEN1KMT2A
SCHEMBL23998926 0.65 CRHR1 (0.37) TDP1L3MBTL1MEN1KMT2A
SCHEMBL15577466 0.65 MAPK1 (0.36) ESR1MEN1KMT2A
SCHEMBL15543565 0.65 MAPK1 (0.36)
SCHEMBL365208 0.63 SCN9A (0.47)
SCHEMBL16175295 0.63 MAPK1 (0.33) KMT2A

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
EP-2593431-B1 N-SULFONYLBENZAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS PFIZER LTD (GB) 2014-11-19 EP disclosed