SCHEMBL14554264

SCHEMBL14554264

C=Cc1ccc(Oc2cccc(Cl)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.44
AR P10275 1/20 0.43
SCN5A Q14524 1/20 0.42
SCN9A Q15858 1/20 0.42
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
MITF O75030 1/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
NLRP1 Q9C000 1/20 0.41
NOD2 Q9HC29 1/20 0.41
NAAA Q02083 1/20 0.41
PGR P06401 2/20 0.40
TERT O14746 1/20 0.40
RHEB Q15382 2/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL10715309 0.84 MAPT (0.54) ARSCN5ASCN9AALDH1A1SMN1; SMN2
SCHEMBL30758651 0.82 ALDH1A1 (0.47) RELAARSCN5ASCN9AALDH1A1
SCHEMBL23244715 0.82 RELA (0.47) RELAARSCN5ASCN9AALDH1A1
SCHEMBL8778154 0.82 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2HPGDMEN1MAPT
SCHEMBL7761800 0.82 ALDH1A1 (0.47) RELAARSCN5ASCN9AALDH1A1
SCHEMBL3716891 0.81 MAOA (0.52) ARSCN5ASCN9AALDH1A1SMN1; SMN2
SCHEMBL29349910 0.81 MAOA (0.52) ARSCN5ASCN9AALDH1A1SMN1; SMN2
SCHEMBL6206121 0.80 RHEB (0.52) ARSCN5ASCN9AALDH1A1SMN1; SMN2
SCHEMBL29924283 0.80 RHEB (0.52) ARSCN5ASCN9AALDH1A1SMN1; SMN2
SCHEMBL5545085 0.79 AR (0.46) ARSCN5ASCN9AALDH1A1SMN1; SMN2

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-2013006596-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED (GB) 2013-01-10 WO disclosed