SCHEMBL3247679

SCHEMBL3247679

COc1cccc(S(=O)(=O)Cl)c1C#N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
TRPV4 Q9HBA0 2/20 0.47
SLC22A12 Q96S37 2/20 0.45
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
PKM P14618 1/20 0.43
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
CYP2C9 P11712 1/20 0.41
HTR6 P50406 1/20 0.41
CCR4 P51679 1/20 0.41
NFE2L2 Q16236 3/20 0.39
KCNH2 Q12809 1/20 0.39
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HSD11B1 P28845 1/20 0.38
HPGDS O60760 1/20 0.38

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
SCHEMBL6862266 0.82 TRPV4 (0.50) NPC1RAB9ATRPV4ALDH1A1CYP1A2
SCHEMBL5528618 0.81 L3MBTL1 (0.46) NPC1RAB9ASLC22A12ALDH1A1CYP1A2
SCHEMBL302695 0.81 ALDH1A1 (0.53) NPC1RAB9ASLC22A12ALDH1A1CYP1A2
SCHEMBL30753930 0.80 ALDH1A1 (0.50) NPC1RAB9ATRPV4SLC22A12ALDH1A1
SCHEMBL162306 0.80 ALDH1A1 (0.50) NPC1RAB9ATRPV4SLC22A12ALDH1A1
SCHEMBL646910 0.80 TRPV4 (0.47) TRPV4SLC22A12MAPTEPAS1
SCHEMBL2570257 0.79 SLC22A12 (0.47) TRPV4SLC22A12ALDH1A1CYP1A2CYP3A4
SCHEMBL22980481 0.79 TRPV4 (0.53) TRPV4ALDH1A1LMNAHTR6CCR4
SCHEMBL4739158 0.78 RAB9A (0.59) NPC1RAB9AALDH1A1CYP3A4MAPT
SCHEMBL4972108 0.77 CYP1A2 (0.43) TRPV4SLC22A12ALDH1A1CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1819668-B1 NOVEL 2-CYANO-3-(HALO)ALKOXY-BENZENESULFONAMIDE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2010-05-26 EP disclosed
US-7563921-B2 2-cyano-3(halo)alkoxy-benzenesulfonamide compounds for combating animal pests BASF AKTIENGESELLSCHAFT (DE) 2009-07-21 US disclosed
US-7544637-B2 2-cyano-3(halo)alkoxy-benzenesulfonamide compounds for combating animal pests BASF AKTIENGESELLSCHAFT (DE) 2009-06-09 US disclosed
US-20080306297-A1 NOVEL 2-CYANO-3(HALO)ALKOXY-BENZENESULFONAMIDE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2008-12-11 US disclosed
US-20080063678-A1 Novel 2-Cyano-3(Halo)Alkoxy-Benzenesulfonamide Compounds for Combating Animal Pests BASF AKTIENGESELLSCHAFT (DE) 2008-03-13 US disclosed
EP-1819668-A2 NOVEL 2-CYANO-3-(HALO)ALKOXY-BENZENESULFONAMIDE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF AKTIENGESELLSCHAFT (DE) 2007-08-22 EP disclosed
US-20070071782-A1 2-Cyanobenzenesulfonamides for combating animal pests BASF AKTIENGESELLSCHAFT (DE) 2007-03-29 US disclosed
EP-1670752-A1 2-CYANOBENZENESULFONAMIDES FOR COMBATING ANIMAL PESTS BASF AKTIENGESELLSCHAFT (DE) 2006-06-21 EP disclosed
WO-2006056433-A2 NOVEL 2-CYANO-3-(HALO)ALKOXY-BENZENESULFONAMIDE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF AKTIENGESELLSCHAFT (DE) 2006-06-01 WO disclosed
WO-2005035486-A1 2-CYANOBENZENESULFONAMIDES FOR COMBATING ANIMAL PESTS BASF AKTIENGESELLSCHAFT (DE) 2005-04-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070071782-A1 2-Cyanobenzenesulfonamides for combating animal pests MSR1, CHRM2, CBS NPC1 2328/4885RAB9A 1561/4885TRPV4 2509/4885
US-20080306297-A1 NOVEL 2-CYANO-3(HALO)ALKOXY-BENZENESULFONAMIDE COMPOUNDS FOR COMBATING ANIMAL PESTS CBR3, CNPY3, CNPY2 NPC1 1655/4885RAB9A 3014/4885TRPV4 1423/4885
US-20080063678-A1 Novel 2-Cyano-3(Halo)Alkoxy-Benzenesulfonamide Compounds for Combating Animal Pests CNPY2, CNPY3, CBR3 NPC1 1733/4885RAB9A 3212/4885TRPV4 1839/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.