SCHEMBL4906305

SCHEMBL4906305

COC(=O)c1cc(S(=O)(=O)NCCc2ccc(OCc3cccc(F)c3F)cc2)ccc1C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.47
AKR1C3 P42330 2/20 0.46
MAPT P10636 5/20 0.46
LMNA P02545 4/20 0.45
RECQL P46063 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
SGMS1 Q86VZ5 2/20 0.43
TBXA2R P21731 1/20 0.43
TBXAS1 P24557 1/20 0.43
GAA P10253 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
SCHEMBL4905968 0.93 TP53 (0.49) TP53AKR1C3MAPTLMNARECQL
SCHEMBL4906938 0.92 AKR1C3 (0.46) TP53AKR1C3MAPTLMNAALDH1A1
SCHEMBL4895653 0.91 AKR1C3 (0.43) TP53AKR1C3MAPTLMNAALDH1A1
SCHEMBL5376620 0.86 SMN1; SMN2 (0.53) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL4905824 0.86 MAPT (0.50) TP53AKR1C3MAPTLMNARECQL
SCHEMBL4904138 0.86 AKR1C3 (0.48) TP53AKR1C3MAPTLMNAALDH1A1
SCHEMBL4906442 0.85 MAPT (0.50) TP53AKR1C3MAPTLMNARECQL
SCHEMBL4904019 0.85 ALDH1A1 (0.57) TP53AKR1C3MAPTLMNAALDH1A1
SCHEMBL4907002 0.85 AKR1C3 (0.46) TP53AKR1C3MAPTLMNARECQL
SCHEMBL4906213 0.84 MMP2 (0.53) TP53AKR1C3MAPTLMNARECQL

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 TP53 3260/4885AKR1C3 1604/4885MAPT 1858/4885
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD TP53 3421/4885AKR1C3 1645/4885MAPT 1786/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD TP53 3421/4885AKR1C3 1645/4885MAPT 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.