SCHEMBL14718277

SCHEMBL14718277

C[C@@H]1CC[C@@H](C(=O)N2C(=O)OCC2Cc2ccccc2)[C@H](C)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.42
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
FAAH O00519 1/20 0.38
IDH1 O75874 10/20 0.38
PPARA Q07869 2/20 0.38
ATM Q13315 1/20 0.37
IL6ST P40189 1/20 0.36

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
SCHEMBL14645224 1.00 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL14645206 1.00 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL14645216 1.00 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL14645207 1.00 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL14645217 1.00 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL4015233 0.85 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL3940865 0.85 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL4015232 0.85 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL3940861 0.85 NAAA (0.42) NAAACSNK2BCSNK2A1FAAHIDH1
SCHEMBL18204815 0.84 NAAA (0.41) NAAACSNK2BCSNK2A1FAAHIDH1

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-2734515-B1 THIOPHEN-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS INHIBITORS OF FLAVIVIRIDAE VIRUSES GILEAD SCIENCES INC (US) 2015-11-04 EP disclosed
US-8741946-B2 Inhibitors of flaviviridae viruses GILEAD SCIENCES, INC. (US) 2014-06-03 US disclosed
US-20130052161-A1 INHIBITORS OF FLAVIVIRIDAE VIRUSES GILEAD SCIENCES, INC. (US) 2013-02-28 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-20130052161-A1 INHIBITORS OF FLAVIVIRIDAE VIRUSES HAVCR2, CYP2F1, CYP4F3 NAAA 2224/4885CSNK2B 2722/4885CSNK2A1 2763/4885

“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.