SCHEMBL2276993

SCHEMBL2276993

Cc1cc(C)cc(OC(CCS(=O)(=O)Cl)C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.40
PPARA Q07869 15/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
FOLH1 Q04609 1/20 0.35
CTRC Q99895 1/20 0.33

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
SCHEMBL2280554 0.76 SMN1; SMN2 (0.65) PPARGPPARASMN1; SMN2PTGESALOX5
SCHEMBL2874282 0.71 PPARG (0.40) PPARGPPARASMN1; SMN2PTGESALOX5
SCHEMBL3391374 0.70 PPARG (0.48) PPARGPPARACTRC
SCHEMBL10638079 0.68 SMN1; SMN2 (0.46) PPARGPPARASMN1; SMN2
SCHEMBL2276986 0.68 SMN1; SMN2 (0.61) PPARGPPARASMN1; SMN2PTGDR2
SCHEMBL7255301 0.67 PPARG (0.64) PPARGPPARASMN1; SMN2PTGESALOX5
SCHEMBL6507757 0.67 TDP1 (0.61) PPARGPPARASMN1; SMN2
SCHEMBL7267831 0.67 TPMT (0.41) SMN1; SMN2
SCHEMBL11325584 0.66 PPARG (0.50) PPARGPPARASMN1; SMN2ALOX5FOLH1
SCHEMBL27602676 0.65 AR (0.51) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7998462-B2 Linkers for anchoring targeting ligands KEREOS, INC. (US) 2011-08-16 US disclosed
EP-2094311-A2 IMPROVED LINKERS FOR ANCHORING TARGETING LIGANDS KEREOS, INC. (US) 2009-09-02 EP disclosed
US-20080305037-A1 LINKERS FOR ANCHORING TARGETING LIGANDS KEREOS, INC. 2008-12-11 US disclosed
WO-2008070291-A2 IMPROVED LINKERS FOR ANCHORING TARGETING LIGANDS KEREOS, INC. (US) 2008-06-12 WO 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-20080305037-A1 LINKERS FOR ANCHORING TARGETING LIGANDS LDLR, HDLBP, FABP1 PPARG 1620/4885PPARA 970/4885SMN1; SMN2 4043/4885

“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.