SCHEMBL16980371

SCHEMBL16980371

COCC(=O)Nc1ccc2c(c1)C(=O)N(C)[C@H]1CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]1CO2

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PAX8 Q06710 6/20 0.62
▸ CASP6 P55212 2/20 0.59
▸ PLCG1 P19174 4/20 0.57
▸ PLCB3 Q01970 4/20 0.57
▸ SIRT5 Q9NXA8 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MALT1 Q9UDY8 3/20 0.37
▸ ALDH1A1 P00352 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
SCHEMBL17860358 0.91 PAX8 (0.65) PAX8CASP6PLCG1PLCB3MALT1
SCHEMBL17860394 0.89 PAX8 (0.65) PAX8CASP6PLCG1PLCB3KDM4E
SCHEMBL17860317 0.88 PAX8 (0.64) PAX8CASP6PLCG1PLCB3KDM4E
SCHEMBL17860363 0.88 PAX8 (0.68) PAX8CASP6PLCG1PLCB3KDM4E
SCHEMBL17860372 0.87 PAX8 (0.69) PAX8CASP6PLCG1PLCB3KDM4E
SCHEMBL17860371 0.87 PAX8 (0.67) PAX8CASP6PLCG1PLCB3
SCHEMBL17860365 0.87 PAX8 (0.63) PAX8CASP6PLCG1PLCB3KDM4E
SCHEMBL17860360 0.87 PAX8 (0.67) PAX8CASP6PLCG1PLCB3MALT1
SCHEMBL17860453 0.87 PAX8 (0.73) PAX8CASP6PLCG1PLCB3MALT1
SCHEMBL17860516 0.87 PAX8 (0.65) PAX8CASP6PLCG1PLCB3L3MBTL1

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-9526720-B2 Modulators of hepatic lipoprotein metabolism THE BROAD INSTITUTE, INC. (US) 2016-12-27 — — US disclosed
US-9526720-B2 Modulators of hepatic lipoprotein metabolism THE BROAD INSTITUTE, INC. (US) 2016-12-27 — — US disclosed
US-20150216855-A1 Modulators of Hepatic Lipoprotein Metabolism THE BROAD INSTITUTE, INC. 2015-08-06 — — US disclosed
US-20150216855-A1 Modulators of Hepatic Lipoprotein Metabolism THE BROAD INSTITUTE, INC. 2015-08-06 — — 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-20150216855-A1 Modulators of Hepatic Lipoprotein Metabolism CETP, LIPC, SLC10A1 PAX8 4881/4885CASP6 4001/4885PLCG1 1203/4885

“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.

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