SCHEMBL4469024

SCHEMBL4469024

COc1cc(Cl)c(S(=O)(=O)Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
TRPV4 Q9HBA0 1/20 0.40
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
PKM P14618 3/20 0.36
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
RAPGEF4 Q8WZA2 1/20 0.34
NFE2L2 Q16236 2/20 0.34
FFAR4 Q5NUL3 1/20 0.34
NPC1 O15118 1/20 0.33

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
SCHEMBL16478541 0.81 ALDH1A1 (0.40) ALDH1A1CYP1A1CYP1B1PKMFLT1
SCHEMBL152815 0.78 RAPGEF4 (0.46) ALDH1A1TRPV4CYP1A1CYP1B1PKM
SCHEMBL2496728 0.78 CYP1A2 (0.47) ALDH1A1TRPV4CYP1A1CYP1B1KDM4E
SCHEMBL2205517 0.77 RAPGEF4 (0.44) ALDH1A1TRPV4CYP1A1CYP1B1PKM
SCHEMBL22146099 0.77 PKM (0.48) ALDH1A1TRPV4CYP1A1CYP1B1PKM
1,3,5-Trimethoxybenzene SCHEMBL2496933 0.76 ALDH1A1 (0.65) ALDH1A1CYP1A1CYP1B1PKMCYP1A2
SCHEMBL4512524 0.75 CA1 (0.35) ALDH1A1TRPV4KDM4EGAAMAPT
SCHEMBL181647 0.74 ALDH1A1 (0.43) ALDH1A1TRPV4CNR1CYP3A4AHR
SCHEMBL2833625 0.74 RAPGEF4 (0.42) ALDH1A1CYP1A1CYP1B1LMNACYP1A2
SCHEMBL4065639 0.74 TRPV4 (0.53) ALDH1A1TRPV4FLT1FLT4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538111-B2 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2009-05-26 US disclosed
US-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2006-08-10 US 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 (1 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-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LTB4R2, BDKRB2, TBXA2R ALDH1A1 283/4885TRPV4 113/4885CYP1A1 94/4885

“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.