SCHEMBL4480977

SCHEMBL4480977

CC(=O)Nc1ccc2c(S(=O)(=O)Cl)cccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.50
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
ALDH1A1 P00352 2/20 0.46
ESRRA P11474 1/20 0.45
PRMT3 O60678 1/20 0.44
EP300 Q09472 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
PRMT1 Q99873 1/20 0.44
CYP1A2 P05177 1/20 0.44
HSD17B10 Q99714 1/20 0.44
FABP7 O15540 1/20 0.44
FABP3 P05413 1/20 0.44
FABP5 Q01469 1/20 0.44
POLB P06746 1/20 0.44
ENPP2 Q13822 1/20 0.44
KLK7 P49862 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL8784899 0.89 ESRRA (0.48) ALDH1A1ESRRACYP1A2HSD17B10POLB
SCHEMBL8784533 0.88 CASP6 (0.59) CASP6HSD17B1HSD17B2ALDH1A1PRMT3
SCHEMBL9747665 0.87 ALDH1A1 (0.57) CASP6HSD17B1HSD17B2ALDH1A1PRMT3
SCHEMBL6124914 0.82 ALDH1A1 (0.44) ALDH1A1POLBENPP2KDM4EMEN1
SCHEMBL10390889 0.78 ENPP2 (0.51) CASP6HSD17B1HSD17B2ALDH1A1ESRRA
SCHEMBL4474391 0.77 NSD2 (0.49) ALDH1A1MEN1MAPTKMT2A
SCHEMBL6138266 0.77 MAPT (0.60) HSD17B1HSD17B2ALDH1A1ESRRACYP1A2
SCHEMBL1122275 0.77 HSD17B1 (0.76) CASP6HSD17B1HSD17B2ALDH1A1CYP1A2
SCHEMBL19355161 0.77 HSD17B1 (0.55) CASP6HSD17B1HSD17B2ALDH1A1CYP1A2
SCHEMBL29963136 0.77 HSD17B1 (0.76) CASP6HSD17B1HSD17B2ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US disclosed
US-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US disclosed
US-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US disclosed
US-20050215645-A1 Amide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2005-09-29 US disclosed
EP-0558258-B1 N-isoxazole-naphthylsulfonamide derivatives and their use as endothelin antagonists SQUIBB & SONS INC (US) 1997-05-07 EP disclosed
US-5378715-A Sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB CO. (US) 1995-01-03 US disclosed
EP-0558258-A1 N-isoxazole-naphthylsulfonamide derivatives and their use as endothelin antagonists E.R. SQUIBB & SONS, INC. (US) 1993-09-01 EP disclosed
EP-0511152-A2 Quinoxaline compounds, their preparation and use NOVO NORDISK A/S (DK) 1992-10-28 EP 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-20050215645-A1 Amide derivatives OGG1, HDAC1, BCL2A1 CASP6 381/4885HSD17B1 2248/4885HSD17B2 2483/4885

“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.