SCHEMBL8955760

SCHEMBL8955760

CCc1cccc(C(=O)OC)c1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 1/20 0.48
CLCN2 P51788 1/20 0.47
TSHR P16473 2/20 0.46
HIF1A Q16665 2/20 0.44
CFTR P13569 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
MAPT P10636 2/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL5772033 0.89 CA1 (0.52) ALDH1A1LMNAHTTCLCN2TSHR
SCHEMBL8481567 0.88 LMNA (0.47) ALDH1A1LMNATSHRHIF1ACFTR
SCHEMBL8481562 0.88 ALDH1A1 (0.47) ALDH1A1LMNAHTTTSHRHIF1A
SCHEMBL8384755 0.87 ALDH1A1 (0.50) ALDH1A1LMNAHTTTSHRHIF1A
SCHEMBL10484451 0.85 ALDH1A1 (0.45) ALDH1A1LMNAHTTCLCN2TSHR
SCHEMBL28551648 0.85 TSHR (0.50) ALDH1A1LMNAHTTCLCN2TSHR
SCHEMBL8669430 0.85 TSHR (0.55) ALDH1A1LMNATSHRCFTRHSD17B10
SCHEMBL123735 0.83 CLCN2 (0.54) ALDH1A1CLCN2HSD17B10ALOX15KDM4E
SCHEMBL8922424 0.83 PPARA (0.48) ALDH1A1LMNAKDM4EPPARA
SCHEMBL27963569 0.82 CLCN2 (0.41) CLCN2PPARA

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
EP-0690112-A1 Cyanoacrylate adhesive compositions TAOKA CHEMICAL COMPANY, LIMITED (JP) 1996-01-03 EP disclosed