SCHEMBL8526683

SCHEMBL8526683

CCCCCCCCc1cc(O)ccc1-c1ccc(C(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 12/20 0.57
MEN1 O00255 2/20 0.57
MAPT P10636 2/20 0.57
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 1/20 0.57
RARA P10276 1/20 0.57
MTOR P42345 1/20 0.57
PTPN11 Q06124 1/20 0.52
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX5 P09917 1/20 0.50
TYR P14679 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
HTT P42858 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
BID P55957 3/20 0.48
MCL1 Q07820 3/20 0.48
BCL2L1 Q07817 2/20 0.48
BAK1 Q16611 2/20 0.48

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
SCHEMBL10391891 1.00 RARB (0.57) RARBMEN1MAPTKMT2AALDH1A1
SCHEMBL9394701 0.92 RARB (0.61) RARBMEN1MAPTKMT2AALDH1A1
SCHEMBL8526681 0.92 RARB (0.61) RARBMEN1MAPTKMT2AALDH1A1
SCHEMBL10438718 0.87 ALOX5 (0.60) MEN1MAPTKMT2AALDH1A1TP53
Hydrochloric Acid SCHEMBL8746734 0.86 RARB (0.63) RARBMEN1MAPTKMT2AALDH1A1
SCHEMBL10441217 0.84 ALOX5 (0.57) MEN1MAPTKMT2AALDH1A1TP53
SCHEMBL11056289 0.84 ALOX5 (0.57) MEN1MAPTKMT2AALDH1A1TP53
SCHEMBL10441000 0.84 ALOX5 (0.57) MEN1MAPTKMT2AALDH1A1TP53
SCHEMBL9507976 0.84 RARB (0.70) RARBMEN1MAPTKMT2AALDH1A1
SCHEMBL6884342 0.84 SRD5A2 (0.53) ALDH1A1PTPN11TYR

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
US-5891358-A ELECTROCLINIC DEVICE COMPRISING TWO SPACED CELL WALLS EACH BEARING ELECTRODE STRUCTURES AND TREATED ON AT LEAST ONE FACING SURFACE WITH AN ALIGNMENT LAYER, A LAYER OF A SMECTIC LIQUID CRYSTAL MATERIAL ENCLOSED BETWEEN THE CELL WALLS SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITIAN & NORTHERN IRELAND OF DEFENCE EVALUATION & RESEARCH AGENCY (GB) 1999-04-06 US disclosed