SCHEMBL7473301

SCHEMBL7473301

CCOC(=O)c1cccc(CC)c1.O=S(=O)(O)Cl

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.61
CYP4A11 Q02928 1/20 0.61
CA2 P00918 2/20 0.56
MEP1B Q16820 1/20 0.53
MAPT P10636 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.46

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
SCHEMBL129801 0.91 CYP4F2 (0.71) CYP4F2CYP4A11CA2MEP1BMAPT
SCHEMBL7464858 0.88 LMNA (0.55) CYP4F2CYP4A11CA2MAPTALDH1A1
SCHEMBL7471658 0.86 LOXL2 (0.62) CYP4F2CYP4A11CA2MAPTRAB9A
SCHEMBL7471861 0.86 TRPV1 (0.56) CYP4F2CYP4A11CA2RAB9AALDH1A1
SCHEMBL7467811 0.86 TDP1 (0.52) CYP4F2CYP4A11CA2NPC1RAB9A
SCHEMBL7472353 0.85 KDM4E (0.56) CYP4F2CYP4A11CA2MEP1BNPC1
SCHEMBL27425790 0.84 LMNA (0.57) CYP4F2CYP4A11CA2MAPTALDH1A1
SCHEMBL7471102 0.84 POLB (0.54) CYP4F2CYP4A11CA2NPC1SMN1; SMN2
SCHEMBL1198044 0.83 CYP4F2 (0.66) CYP4F2CYP4A11CA2MEP1BMAPT
SCHEMBL7475996 0.82 SMN1; SMN2 (0.56) MAPTNPC1RAB9AALDH1A1SMN1; SMN2

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
EP-0859774-B1 SUBSTITUTED SULPHONYLAMINO (THIO)CARBONYL COMPOUNDS AS HERBICIDES BAYER AG (DE) 2002-04-03 EP disclosed
EP-0859774-A1 SUBSTITUTED SULPHONYLAMINO (THIO)CARBONYL COMPOUNDS AS HERBICIDES BAYER AG (DE) 1998-08-26 EP disclosed
WO-1997016449-A1 SUBSTITUTED SULPHONYLAMINO (THIO)CARBONYL COMPOUNDS AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-05-09 WO disclosed