Sugi Predict

Sugi Predict / Compounds / SCHEMBL4906441

SCHEMBL4906441

SCHEMBL4906441

CCc1ccc(S(=O)(=O)NCCc2ccc(OCc3cccc(C)c3C)cc2)cc1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 2/20 0.46
▸ ALDH1A1 P00352 4/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ TBXA2R P21731 1/20 0.43
▸ TBXAS1 P24557 1/20 0.43
▸ SGMS1 Q86VZ5 4/20 0.43
▸ FFAR1 O14842 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 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
SCHEMBL4907266 0.92 AKR1C3 (0.49) AKR1C3ALDH1A1TBXA2RTBXAS1SGMS1
SCHEMBL4900677 0.89 AKR1C3 (0.46) AKR1C3ALDH1A1SMN1; SMN2TBXA2RTBXAS1
SCHEMBL4906938 0.87 AKR1C3 (0.46) AKR1C3ALDH1A1SMN1; SMN2TBXA2RTBXAS1
SCHEMBL4895776 0.83 ALDH1A1 (0.55) AKR1C3ALDH1A1SMN1; SMN2SGMS1PTPN1
SCHEMBL4894509 0.83 AKR1C3 (0.48) AKR1C3ALDH1A1TBXA2RTBXAS1SGMS1
SCHEMBL4906567 0.83 MMP2 (0.52) AKR1C3ALDH1A1SMN1; SMN2TBXA2RTBXAS1
SCHEMBL4906305 0.82 TP53 (0.47) AKR1C3ALDH1A1SMN1; SMN2TBXA2RTBXAS1
SCHEMBL4904696 0.82 MAPT (0.49) AKR1C3ALDH1A1SMN1; SMN2TBXA2RTBXAS1
SCHEMBL4903736 0.81 ALDH1A1 (0.49) AKR1C3ALDH1A1SMN1; SMN2MEN1GAA
SCHEMBL4904384 0.81 ERBB2 (0.49) AKR1C3ALDH1A1SMN1; SMN2PTPN1

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 AKR1C3 1604/4885ALDH1A1 2664/4885SMN1; SMN2 3271/4885
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD AKR1C3 1645/4885ALDH1A1 2956/4885SMN1; SMN2 3404/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD AKR1C3 1645/4885ALDH1A1 2956/4885SMN1; SMN2 3404/4885

“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.