SCHEMBL1644361

SCHEMBL1644361

Cc1cc(OCc2ccc(C(=O)O)cc2)c(N(C[C@@H](C)F)S(=O)(=O)c2ccccn2)cc1C

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.44
RXRB P28702 6/20 0.44
RXRG P48443 5/20 0.44
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37

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
SCHEMBL12361934 1.00 RXRA (0.44) RXRARXRBRXRGHPGDKDM4E
SCHEMBL1645342 1.00 RXRA (0.44) RXRARXRBRXRGHPGDKDM4E
SCHEMBL12361936 0.93 NR1H4 (0.42) RXRARXRBRXRGHPGDKDM4E
SCHEMBL1645524 0.93 NR1H4 (0.42) RXRARXRBRXRGHPGDKDM4E
SCHEMBL1644223 0.93 NR1H4 (0.42) RXRARXRBRXRGHPGDKDM4E
SCHEMBL215215 0.93 RXRA (0.46) RXRARXRBRXRGHPGDKDM4E
SCHEMBL12361855 0.91 ALDH1A1 (0.43) HPGDKDM4EALDH1A1
SCHEMBL12361854 0.91 ALDH1A1 (0.43) HPGDKDM4EALDH1A1
SCHEMBL1644693 0.91 ALDH1A1 (0.43) HPGDKDM4EALDH1A1
SCHEMBL1645226 0.91 RXRA (0.43) RXRARXRBRXRGHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF ASTELLAS PHARMA INC. (JP) 2011-08-18 US claimed
EP-2305641-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-04-06 EP claimed
US-8314240-B2 Sulfonamide compounds or salts thereof ASTELLAS PHARMA INC. (JP) 2012-11-20 US disclosed
US-8314240-B2 Sulfonamide compounds or salts thereof ASTELLAS PHARMA INC. (JP) 2012-11-20 US disclosed
US-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF ASTELLAS PHARMA INC. (JP) 2011-08-18 US disclosed
US-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF ASTELLAS PHARMA INC. (JP) 2011-08-18 US disclosed
EP-2305641-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-04-06 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-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF PTGER1, PTGER2, GPER1 RXRA 2466/4885RXRB 3083/4885RXRG 3015/4885

“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.