SCHEMBL14713356

SCHEMBL14713356

CCC(C(C)=O)c1cc(CO)c(CO)cc1C(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPK1 P28482 1/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 2/20 0.43
ACHE P22303 3/20 0.42
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA7 P43166 1/20 0.40
TPMT P51580 1/20 0.40
CA9 Q16790 1/20 0.40

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
SCHEMBL4282581 0.89 TSHR (0.54) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
Ethylene SCHEMBL6410194 0.87 TSHR (0.51) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL14448347 0.86 TSHR (0.50) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL14582854 0.85 TUBB4A (0.43) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL14448350 0.85 MAPK1 (0.53) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL3247280 0.85 CYP3A4 (0.49) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL14582856 0.83 SMPD1 (0.49) MAPTACHESMN1; SMN2BCHE
SCHEMBL3854017 0.81 TUBB4A (0.48) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL8337903 0.81 SMPD1 (0.48) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL8323174 0.81 SMPD1 (0.48) TSHRCYP1A2CYP3A4CYP2C9CYP2C19

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-9408852-B2 Method of lowering serum uric acid levels with (S)-tofisopam PHARMOS CORPORATION (US) 2016-08-09 US disclosed
US-20130045966-A1 Method of Lowering Serum Uric Acid Levels With (S)-Tofisopam PHARMOS CORPORATION (US) 2013-02-21 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-20130045966-A1 Method of Lowering Serum Uric Acid Levels With (S)-Tofisopam ATIC, NPPA, XPNPEP1 TSHR 1549/4885CYP1A2 1854/4885CYP3A4 2252/4885

“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.