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SCHEMBL4899776

SCHEMBL4899776

COC(=O)c1cc(S(=O)(=O)NCCSc2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)cc(C)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 12/20 0.43
▸ TSHR P16473 4/20 0.43
▸ LMNA P02545 3/20 0.43
▸ HTT P42858 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ MMP9 P14780 2/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MMP3 P08254 1/20 0.36
▸ MMP7 P09237 1/20 0.36
▸ MMP8 P22894 1/20 0.36
▸ MMP14 P50281 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36

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
SCHEMBL4907037 0.97 ALDH1A1 (0.45) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4899554 0.93 ALDH1A1 (0.42) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4902541 0.93 ALDH1A1 (0.42) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4905593 0.91 ALDH1A1 (0.53) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4902978 0.91 ALDH1A1 (0.53) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4904193 0.91 ALDH1A1 (0.47) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4906552 0.90 ALDH1A1 (0.49) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4895546 0.90 ALDH1A1 (0.44) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4902594 0.90 ALDH1A1 (0.44) ALDH1A1TSHRLMNAHTTHSD17B10
SCHEMBL4905342 0.89 ALDH1A1 (0.44) ALDH1A1TSHRLMNAHTTHSD17B10

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
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 — — US disclosed
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 — — US disclosed
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 — — US disclosed
US-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds HAMANAKA ERNEST S 2006-10-12 — — US disclosed
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER INC 2005-12-29 — — 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 (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-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARA, PPARG, PPARD ALDH1A1 2664/4885TSHR 412/4885LMNA 317/4885
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885LMNA 319/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885LMNA 319/4885

“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.