SCHEMBL20008855

SCHEMBL20008855

CC(F)(F)C(OC(=O)c1ccc(Oc2ccc(C(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)O)cc2)cc1)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 1/20 0.36
LMNA P02545 1/20 0.34
ALDH1A1 P00352 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ELANE P08246 2/20 0.33
FAAH O00519 1/20 0.33
EPHX2 P34913 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
STS P08842 1/20 0.33
PARP10 Q53GL7 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL17195514 0.93 CA1 (0.37) MAPTRAB9ALMNAALDH1A1SMN1; SMN2
SCHEMBL20008852 0.89 CA12 (0.34) HPGDMAPTLMNASMN1; SMN2ELANE
SCHEMBL20008847 0.87 POLB (0.38) MAPTLMNAALDH1A1ELANETSHR
SCHEMBL18785843 0.85 TSHR (0.38) HPGDMAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL12216078 0.85 CA1 (0.47) MAPTRAB9AELANEPARP10CA1
SCHEMBL18785300 0.83 MAPT (0.43) MAPTLMNAALDH1A1SMN1; SMN2ELANE
SCHEMBL383521 0.82 TRPV1 (0.41) MAPTRAB9ALMNAALDH1A1EPHX2
SCHEMBL18785982 0.82 TDP1 (0.43) MAPTLMNAALDH1A1SMN1; SMN2CA12
SCHEMBL1671972 0.81 TRPV1 (0.40) MAPTRAB9ALMNAALDH1A1EPHX2
SCHEMBL18785976 0.80 MAPT (0.37) MAPTRAB9ASMN1; SMN2HTTCA12

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-20180085019-A1 ADHESIVE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING A BIO-ELECTRODE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-03-29 US disclosed