SCHEMBL8988154

SCHEMBL8988154

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
TSHR P16473 2/20 0.38
ELANE P08246 1/20 0.37
CASP1 P29466 1/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA14 Q9ULX7 2/20 0.36
HPGD P15428 2/20 0.35
LMNA P02545 2/20 0.33
THRB P10828 1/20 0.33
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
MAPKAPK2 P49137 1/20 0.31

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
SCHEMBL716320 0.83 GABRA1 (0.46) GABRA1GABRB2TSHRELANECASP1
Phosphoric Acid SCHEMBL27613326 0.78 GABRA1 (0.41) GABRA1GABRB2TSHRELANECASP1
SCHEMBL962438 0.77 HPGD (0.50) ELANEHPGDLMNAALDH1A1
SCHEMBL29128719 0.75 TSHR (0.47) GABRA1GABRB2TSHRELANECA12
SCHEMBL27835359 0.74 CA1 (0.41) GABRA1GABRB2TSHRELANECA12
SCHEMBL9843253 0.74 CA1 (0.39) TSHRELANECA12CA1CA2
SCHEMBL5611534 0.74 ELANE (0.45) GABRA1GABRB2TSHRELANECA1
SCHEMBL960076 0.73 AKR1B1 (0.40) TSHRELANECA12CA1CA2
SCHEMBL7901257 0.72 MAPT (0.41) ELANECA12CA1CA2CA7
SCHEMBL17351289 0.71 ELANE (0.45) ELANEHPGDLMNAALDH1A1

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-5576137-A PHOTOLITHOGRAPHY AGFA-GEVAERT AG (DE) 1996-11-19 US disclosed