SCHEMBL4904860

SCHEMBL4904860

COC(=O)c1cc(S(=O)(=O)NCCSc2ccc(Oc3ccc(F)cc3)cc2)ccc1C

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.57
TSHR P16473 4/20 0.57
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
GAA P10253 1/20 0.51
LMNA P02545 4/20 0.50
HTT P42858 2/20 0.50
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 1/20 0.40
SCN9A Q15858 1/20 0.40

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
SCHEMBL4905961 0.92 ALDH1A1 (0.57) ALDH1A1TSHRMAPTKMT2AMEN1
SCHEMBL4904015 0.92 ALDH1A1 (0.54) ALDH1A1TSHRMAPTLMNAHTT
SCHEMBL4902846 0.92 ALDH1A1 (0.60) ALDH1A1TSHRMAPTLMNAHTT
SCHEMBL4895337 0.91 ALDH1A1 (0.48) ALDH1A1TSHRMAPTKMT2AMEN1
SCHEMBL4906552 0.91 ALDH1A1 (0.49) ALDH1A1TSHRMAPTKMT2AMEN1
SCHEMBL4905789 0.91 ALDH1A1 (0.51) ALDH1A1TSHRMAPTKMT2AMEN1
SCHEMBL4902649 0.91 ALDH1A1 (0.54) ALDH1A1TSHRMAPTGAALMNA
SCHEMBL4905593 0.90 ALDH1A1 (0.53) ALDH1A1TSHRMAPTKMT2AMEN1
SCHEMBL4906306 0.90 ALDH1A1 (0.50) ALDH1A1TSHRMAPTKMT2AMEN1
SCHEMBL4906669 0.90 ALDH1A1 (0.60) ALDH1A1TSHRMAPTKMT2AMEN1

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 4 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

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

For each of this compound's patents that has machine-readable text (2 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 412/4885MAPT 1858/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885MAPT 1786/4885

“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.