SCHEMBL5774048

SCHEMBL5774048

CC1CN(c2ccc(C(F)(F)F)cn2)CC(C)N1S(=O)(=O)c1ccc(O)c(CCC(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.45
HCRTR1 O43613 2/20 0.41
HCRTR2 O43614 2/20 0.41
CA12 O43570 7/20 0.41
CA1 P00915 7/20 0.41
CA2 P00918 7/20 0.41
CA9 Q16790 7/20 0.41
CA4 P22748 6/20 0.41
CA7 P43166 6/20 0.41
TRPV1 Q8NER1 5/20 0.41
GPR119 Q8TDV5 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
KDM4E B2RXH2 1/20 0.40
S100A4 P26447 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
F13A1 P00488 1/20 0.39
TGM2 P21980 1/20 0.39
TGM1 P22735 1/20 0.39

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
SCHEMBL5749076 0.90 HCRTR1 (0.48) HSD11B1HCRTR1HCRTR2GPR119CHRM2
SCHEMBL5749138 0.85 HSD11B1 (0.46) HSD11B1HCRTR1HCRTR2CA12CA1
SCHEMBL6349104 0.85 HSD11B1 (0.46) HSD11B1HCRTR1HCRTR2CA12CA1
SCHEMBL27734404 0.84 HSD11B1 (0.41) HSD11B1HCRTR1HCRTR2CA12CA1
SCHEMBL5750282 0.83 HCRTR1 (0.49) HSD11B1HCRTR1HCRTR2CA12CA1
SCHEMBL5749711 0.80 HSD11B1 (0.47) HSD11B1HCRTR1HCRTR2CA12CA1
SCHEMBL5800472 0.79 HSD11B1 (0.44) HSD11B1HCRTR1HCRTR2GPR119CHRM2
SCHEMBL5748340 0.79 HSD11B1 (0.47) HSD11B1HCRTR1HCRTR2GPR119CHRM2
SCHEMBL1472588 0.79 HSD11B1 (0.42) HSD11B1HCRTR1HCRTR2CA12CA1
SCHEMBL1470481 0.79 HSD11B1 (0.42) HSD11B1HCRTR1HCRTR2CA12CA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1735280-A1 ARYL SULFONAMIDE AND SULFONYL COMPOUNDS AS MODULATORS OF PPAR AND METHODS OF TREATING METABOLIC DISORDERS Kalypsys, Inc. (US) 2006-12-27 EP disclosed
WO-2005115983-A1 ARYL SULFONAMIDE AND SULFONYL COMPOUNDS AS MODULATORS OF PPAR AND METHODS OF TREATING METABOLIC DISORDERS KALYPSYS, INC. (US) 2005-12-08 WO disclosed
US-20050234046-A1 Aryl sulfonamide and sulfonyl compounds as modulators of PPAR and methods of treating metabolic disorders KALYPSYS, INC. (US) 2005-10-20 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 (1 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-20050234046-A1 Aryl sulfonamide and sulfonyl compounds as modulators of PPAR and methods of treating metabolic disorders PPARA, PPARG, PPARD HSD11B1 668/4885HCRTR1 1605/4885HCRTR2 1317/4885

“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.