SCHEMBL4907002

SCHEMBL4907002

Cc1cc(S(=O)(=O)NCCc2ccc(OCc3cccc(F)c3F)cc2)cc(C(=O)O)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 3/20 0.46
TBXA2R P21731 1/20 0.45
TBXAS1 P24557 1/20 0.45
SGMS1 Q86VZ5 5/20 0.43
TP53 P04637 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
CA9 Q16790 1/20 0.42
MAPT P10636 5/20 0.41
LMNA P02545 3/20 0.41
RECQL P46063 1/20 0.41
ERBB2 P04626 1/20 0.41
ERBB4 Q15303 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 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
SCHEMBL4895653 0.92 AKR1C3 (0.43) AKR1C3TBXA2RTBXAS1SGMS1TP53
SCHEMBL4905968 0.90 TP53 (0.49) AKR1C3TBXA2RTBXAS1SGMS1TP53
SCHEMBL4894509 0.89 AKR1C3 (0.48) AKR1C3TBXA2RTBXAS1SGMS1CA12
SCHEMBL4904138 0.87 AKR1C3 (0.48) AKR1C3TBXA2RTBXAS1SGMS1TP53
SCHEMBL4907048 0.86 MAPT (0.46) AKR1C3TBXA2RTBXAS1SGMS1TP53
SCHEMBL4906488 0.85 MAOA (0.46) AKR1C3TBXA2RTBXAS1SGMS1TP53
SCHEMBL4897615 0.85 ALDH1A1 (0.51) AKR1C3TBXA2RTBXAS1SGMS1ERBB2
SCHEMBL4906305 0.85 TP53 (0.47) AKR1C3TBXA2RTBXAS1SGMS1TP53
SCHEMBL4906724 0.84 MMP2 (0.50) AKR1C3TBXA2RTBXAS1SGMS1TP53
SCHEMBL4897493 0.82 TP53 (0.46) AKR1C3TBXA2RTBXAS1TP53MAPT

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 1604/4885TBXA2R 338/4885TBXAS1 271/4885
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD AKR1C3 1645/4885TBXA2R 330/4885TBXAS1 271/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD AKR1C3 1645/4885TBXA2R 330/4885TBXAS1 271/4885

“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.