SCHEMBL7758046

SCHEMBL7758046

C/C=C/C=C/C(=O)OC(=O)c1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 5/20 0.44
HSD17B10 Q99714 4/20 0.44
ALOX15 P16050 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
MAOB P27338 7/20 0.42
AR P10275 1/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
MAOA P21397 3/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
HMGB1 P09429 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA9 Q16790 1/20 0.39

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
Ethyl Salicylate SCHEMBL28249497 0.81 TSHR (0.53) TSHRLMNAHSD17B10TDP1ALDH1A1
Methyl Salicylate SCHEMBL27893810 0.79 LMNA (0.65) TSHRLMNAHPGDHSD17B10ALOX15
SCHEMBL7299840 0.79 HPGD (0.51) TSHRLMNAHPGDHSD17B10ALOX15
SCHEMBL3651240 0.79 TSHR (0.46) TSHRLMNAHSD17B10TDP1ALDH1A1
SCHEMBL2927602 0.78 TSHR (0.44) TSHRLMNAHSD17B10TDP1ALDH1A1
SCHEMBL29034679 0.78 TSHR (0.44) TSHRLMNAHSD17B10TDP1ALDH1A1
SCHEMBL4177703 0.78 TSHR (0.44) TSHRLMNAHSD17B10TDP1ALDH1A1
SCHEMBL27670977 0.78 TSHR (0.44) TSHRLMNAHSD17B10TDP1ALDH1A1
Methyl Salicylate SCHEMBL28241989 0.77 LMNA (0.61) TSHRLMNAHPGDHSD17B10ALOX15
SCHEMBL28543902 0.76 LMNA (0.60) TSHRLMNAHPGDHSD17B10ALOX15

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-2001085896-A1 CONCENTRATE FOR DILUTION WITH MAINTENANCE OF OR AN INCREASE IN VISCOSITY HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-11-15 WO disclosed