SCHEMBL7658890

SCHEMBL7658890

CCN(OC)S(=O)(=O)c1cc(C(=O)O)ccc1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.65
PKM P14618 2/20 0.59
NPSR1 Q6W5P4 1/20 0.54
POLB P06746 1/20 0.54
MAPT P10636 1/20 0.53
TSHR P16473 3/20 0.53
KMT2A Q03164 3/20 0.52
GAA P10253 2/20 0.52
MEN1 O00255 2/20 0.52
TP53 P04637 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA7 P43166 1/20 0.50
TPMT P51580 1/20 0.50

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
SCHEMBL7663794 0.86 ALDH1A1 (0.79) ALDH1A1PKMNPSR1POLBMAPT
SCHEMBL11176256 0.79 NPSR1 (0.66) ALDH1A1PKMNPSR1POLBMAPT
SCHEMBL7657142 0.77 ALDH1A1 (0.63) ALDH1A1PKMNPSR1POLBMAPT
SCHEMBL11174862 0.77 ALDH1A1 (0.62) ALDH1A1PKMPOLBMAPTTSHR
SCHEMBL2565798 0.76 PKM (0.73) ALDH1A1PKMNPSR1POLBMAPT
SCHEMBL7662985 0.75 ALDH1A1 (0.54) ALDH1A1PKMNPSR1POLBTSHR
SCHEMBL135000 0.75 PKM (0.71) ALDH1A1PKMNPSR1POLBMAPT
SCHEMBL2592861 0.75 PKM (1.00) ALDH1A1PKMNPSR1POLBMAPT
SCHEMBL13543513 0.75 MAPT (0.74) ALDH1A1PKMNPSR1POLBMAPT
SCHEMBL15953709 0.74 PKM (0.57) ALDH1A1PKMNPSR1POLBMAPT

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
US-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-08-15 US disclosed
US-6355633-B1 CONTRACEPTIVES AMERICAN HOME PRODUCTS CORPORATION 2002-03-12 US disclosed
WO-2000058277-A1 ARYL SULFONIC ACIDS AND DERIVATIVES AS FSH ANTAGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-10-05 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-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists FSHR, GNRHR, LHCGR ALDH1A1 3990/4885PKM 4553/4885NPSR1 32/4885

“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.