SCHEMBL4297086

SCHEMBL4297086

C[C@@H](Oc1cccc(CO)c1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.51
CYP1A2 P05177 1/20 0.51
GAA P10253 1/20 0.51
PKM P14618 1/20 0.51
CYP2C19 P33261 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PTGDR2 Q9Y5Y4 1/20 0.48
PPARG P37231 10/20 0.48
PPARA Q07869 6/20 0.48
PPARD Q03181 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.44
PLG P00747 1/20 0.44
PLAU P00749 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 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
SCHEMBL2939051 1.00 CYP2C9 (0.51) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL15672572 0.87 TDP1 (0.51) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL15672574 0.87 TDP1 (0.51) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL7471783 0.87 TDP1 (0.51) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL1125437 0.85 CYP2C9 (0.50) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL11542319 0.85 CYP2C9 (0.50) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL3921799 0.85 CYP2C9 (0.50) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL8694692 0.85 CYP2C9 (0.50) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL11814155 0.85 CYP2C9 (0.50) CYP2C9CYP1A2GAAPKMCYP2C19
SCHEMBL3165356 0.84 PTGDR2 (0.56) CYP2C9CYP1A2GAAPKMCYP2C19

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-2050446-B1 SULFONAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-05-07 EP disclosed
US-20090312328-A1 SULFONAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-12-17 US disclosed
EP-2050446-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2009-04-22 EP 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-20090312328-A1 SULFONAMIDE COMPOUND OR SALT THEREOF PTGER1, CYSLTR1, PTGER2 CYP2C9 3311/4885CYP1A2 2864/4885GAA 3799/4885

“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.