SCHEMBL11217399

SCHEMBL11217399

COc1cccc(OC(=O)C(Cl)(Cl)Cl)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.49
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A1 P04798 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
ALOX5 P09917 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
MAPT P10636 1/20 0.40
PRMT1 Q99873 1/20 0.40
MAOB P27338 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
SCHEMBL9487802 0.84 CA1 (0.50) LMNACA12CA1CA2CA7
SCHEMBL2160010 0.80 NFE2L2 (0.56) NFE2L2KDM4ELMNAHPGDCA12
SCHEMBL3327023 0.78 MAPK1 (0.58) NFE2L2KDM4ELMNAHPGDCA12
SCHEMBL6963260 0.78 NFE2L2 (0.54) NFE2L2KDM4ELMNAHPGDCA12
SCHEMBL2160012 0.78 NFE2L2 (0.54) NFE2L2KDM4ELMNAHPGDCA12
SCHEMBL3624482 0.77 NFE2L2 (0.53) NFE2L2KDM4ELMNAHPGDCA12
SCHEMBL10491994 0.76 ELANE (0.34)
SCHEMBL14375290 0.75 ALDH1A1 (0.47) NFE2L2KDM4EHPGDSMN1; SMN2MAPT
SCHEMBL25434306 0.74 CA1 (0.61) NFE2L2KDM4ELMNAHPGDCA12
SCHEMBL151213 0.74 CA1 (0.61) NFE2L2KDM4ELMNAHPGDCA12

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-4334111-A PYROLYSIS OF PHENYL TRIHALOACETATE THE DOW CHEMICAL COMPANY (US) 1982-06-08 US disclosed