SCHEMBL7471658

SCHEMBL7471658

CCc1cccc(C(=O)OC)c1.O=S(=O)(O)Cl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.62
CYP4F2 P78329 2/20 0.60
CYP4A11 Q02928 2/20 0.60
SLC7A5 Q01650 1/20 0.54
POLB P06746 1/20 0.51
PTPRB P23467 1/20 0.51
MRGPRX4 Q96LA9 4/20 0.50
KAT6A Q92794 1/20 0.50
MAPT P10636 2/20 0.49
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HIF1A Q16665 1/20 0.48
FOLH1 Q04609 1/20 0.47
HPGD P15428 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47

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
SCHEMBL27425792 0.95 LOXL2 (0.64) LOXL2CYP4F2CYP4A11SLC7A5POLB
SCHEMBL126284 0.90 LOXL2 (0.74) LOXL2CYP4F2CYP4A11SLC7A5POLB
SCHEMBL7473301 0.86 CYP4F2 (0.61) CYP4F2CYP4A11MAPTALDH1A1RAB9A
SCHEMBL5969642 0.84 LOXL2 (0.62) LOXL2CYP4F2CYP4A11SLC7A5POLB
Hydroquinone SCHEMBL28832812 0.84 LOXL2 (0.66) LOXL2CYP4F2CYP4A11SLC7A5MRGPRX4
SCHEMBL3932525 0.84 LOXL2 (0.66) LOXL2CYP4F2CYP4A11SLC7A5POLB
SCHEMBL7474110 0.84 NPC1 (0.48) LOXL2CYP4F2CYP4A11SLC7A5POLB
SCHEMBL7464858 0.84 LMNA (0.55) LOXL2CYP4F2CYP4A11SLC7A5POLB
SCHEMBL7472745 0.83 POLB (0.53) LOXL2CYP4F2CYP4A11POLBMAPT
SCHEMBL7467547 0.82 POLB (0.55) LOXL2CYP4F2CYP4A11POLBMAPT

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