SCHEMBL5770063

SCHEMBL5770063

O=C(O)Cc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
L3MBTL1 Q9Y468 1/20 0.56
PKM P14618 2/20 0.56
F13A1 P00488 1/20 0.55
TGM2 P21980 1/20 0.55
TGM1 P22735 1/20 0.55
CNR1 P21554 3/20 0.52
GCK P35557 1/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
HPGD P15428 1/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
KCNH2 Q12809 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46

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
SCHEMBL5471817 0.91 KDM4E (0.57) KDM4EL3MBTL1PKMF13A1TGM2
SCHEMBL5796493 0.91 KDM4E (0.57) KDM4EL3MBTL1PKMF13A1TGM2
SCHEMBL5772309 0.89 KDM4E (0.59) KDM4EL3MBTL1PKMF13A1TGM2
SCHEMBL5749336 0.84 CNR1 (0.59) L3MBTL1CNR1GCKPTGDR2KCNH2
SCHEMBL5748340 0.83 HSD11B1 (0.47) KDM4EPKMPTGDR2SMN1; SMN2HPGD
SCHEMBL5749117 0.82 KDM4E (0.60) KDM4EL3MBTL1PKMF13A1TGM2
SCHEMBL5487074 0.82 KDM4E (0.59) KDM4EL3MBTL1PKMF13A1TGM2
SCHEMBL5474845 0.81 KDM4E (0.54) KDM4EL3MBTL1PKMF13A1TGM2
SCHEMBL5770834 0.81 KDM4E (0.53) KDM4EL3MBTL1PKMF13A1TGM2
SCHEMBL5748667 0.79 PKM (0.55) KDM4EL3MBTL1PKMF13A1TGM2

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 KDM4E 3692/4885L3MBTL1 4277/4885PKM 660/4885

“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.