SCHEMBL4511063

SCHEMBL4511063

COCCOc1ccc(CCCN(C(=O)O)S(=O)(=O)c2ccccc2C)c(Oc2ncc(C(F)(F)F)cc2Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.62
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL3213529 0.94 PPARG (0.63) PPARGALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL3198810 0.90 PPARG (0.58) PPARGALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL3198799 0.90 PPARG (0.58) PPARGALDH1A1LMNAHPGDSMN1; SMN2
Water SCHEMBL3213967 0.88 PPARG (0.61) PPARGALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL4515286 0.88 PPARG (0.68) PPARGALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL3213630 0.86 PPARG (0.63) PPARGLMNASMN1; SMN2
SCHEMBL3216002 0.85 PPARG (0.63) PPARGALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL3196570 0.85 PPARG (0.64) PPARG
SCHEMBL3211067 0.84 PPARG (0.62) PPARGALDH1A1SMN1; SMN2
SCHEMBL4529260 0.83 PPARG (0.61) PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 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 (2 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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PPARG 31/4885ALDH1A1 212/4885LMNA 1909/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 PPARG 30/4885ALDH1A1 118/4885LMNA 2486/4885

“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.