SCHEMBL6570030

SCHEMBL6570030

O=C(NCCCc1ccc(Cl)c(Cl)c1)c1ccccc1O

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.68
ALDH1A1 P00352 1/20 0.68
MAPT P10636 1/20 0.68
HPGD P15428 1/20 0.68
TSHR P16473 1/20 0.68
HTT P42858 1/20 0.68
NPSR1 Q6W5P4 1/20 0.68
HSD17B10 Q99714 1/20 0.68
NLRP1 Q9C000 1/20 0.68
SLC6A5 Q9Y345 1/20 0.61
LIPG Q9Y5X9 10/20 0.61
LIPC P11150 2/20 0.61
POLB P06746 1/20 0.54
NAAA Q02083 1/20 0.53
PYGL P06737 1/20 0.52
RAB9A P51151 1/20 0.52
ESRRG P62508 1/20 0.51

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
SCHEMBL15953203 0.78 LIPG (0.67) SLC6A5LIPGLIPC
SCHEMBL14830756 0.78 LIPG (0.62) SLC6A5LIPGLIPCPYGL
SCHEMBL15952697 0.77 LIPG (0.70) NPC1SLC6A5LIPGLIPCRAB9A
SCHEMBL14830429 0.77 LIPG (0.70) SLC6A5LIPGLIPC
SCHEMBL14829973 0.77 PYGL (0.63) TSHRLIPGLIPCPYGL
Hydrochloric Acid SCHEMBL15769552 0.76 HTT (0.73) NPC1ALDH1A1MAPTHPGDTSHR
SCHEMBL823552 0.76 NAAA (0.84) NPC1ALDH1A1MAPTHPGDTSHR
SCHEMBL6262760 0.76 ALOX15 (0.66) NPC1ALDH1A1MAPTHPGDTSHR
SCHEMBL15953334 0.76 LIPG (1.00) LIPGLIPC
SCHEMBL5707054 0.74 HTT (0.69) NPC1ALDH1A1MAPTHPGDTSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0496608-B1 Substituted pyridinesulfonamide compound or its salt, process for preparing the same, and herbicide containing the same ISHIHARA SANGYO KAISHA (JP) 1995-09-20 EP claimed
EP-1096855-B1 HERBICIDES WITH SUBSTITUTED PHENYLSULFONYLUREAS FOR CONTROLLING WEEDS IN RICE BAYER CROPSCIENCE GMBH (DE) 2004-11-03 EP disclosed
EP-1083790-B1 RETARDING FORMULATIONS OF ACTIVE SUBSTANCES USED FOR PLANT PROTECTION BASF AG (DE) 2004-04-28 EP disclosed
EP-1233672-A2 SYNERGISTIC HERBICIDAL ACTIVE SUBSTANCE COMBINATIONS Bayer Aktiengesellschaft (DE) 2002-08-28 EP disclosed
WO-2001035741-A2 SYNERGISTIC HERBICIDAL ACTIVE SUBSTANCE COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2001-05-25 WO disclosed