SCHEMBL9296377

SCHEMBL9296377

O=CCOC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
ALDH1A1 P00352 2/20 0.47
SRD5A2 P31213 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
LMNA P02545 1/20 0.42
SNCA P37840 1/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
CA3 P07451 1/20 0.41
TYR P14679 1/20 0.41
DRD1 P21728 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41

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
SCHEMBL6272290 0.92 ESR1 (0.47) TSHRALDH1A1TDP1LMNASNCA
SCHEMBL1030901 0.86 TDP1 (0.59) TP53TSHRALDH1A1TDP1LMNA
SCHEMBL11673722 0.84 TDP1 (0.57) TP53TSHRALDH1A1TDP1LMNA
SCHEMBL7090148 0.82 HPGD (0.53) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL2456552 0.82 MAPT (0.49) MAPTTP53TSHRALDH1A1SRD5A2
SCHEMBL5663821 0.82 TRPV1 (0.56) MAPTALDH1A1TDP1LMNACA12
SCHEMBL5665705 0.82 GAA (0.50) MAPTTSHRALDH1A1LMNACA1
SCHEMBL175787 0.82 SNCA (0.59) MAPTTP53TSHRALDH1A1SRD5A2
Hydrochloric Acid SCHEMBL9285006 0.81 SNCA (0.58) MAPTTP53TSHRALDH1A1SRD5A2
SCHEMBL175075 0.81 MAPT (0.47) MAPTTP53TSHRALDH1A1SRD5A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62042321-A None JP disclosed
EP-0583420-A1 BUILT LIQUID DETERGENTS WITH BORIC-POLYOL COMPLEX TO INHIBIT PROTEOLYTIC ENZYME. PROCTER & GAMBLE (US) 1994-02-23 EP disclosed
JP-S6242321-A POLYURETHANE RESIN FOR MAGNETIC RECORDING MEDIUM MITSUBISHI CHEM IND LTD 1987-02-24 JP disclosed