SCHEMBL10113346

SCHEMBL10113346

COC(=O)C(C)(C)COc1ccc(C)cn1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 13/20 0.60
P2RX3 P56373 2/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP2C9 P11712 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL16660881 0.87 DGAT1 (0.46) DGAT1KDM4EALDH1A1HSD17B10CYP2C9
SCHEMBL374769 0.84 DGAT1 (0.58) DGAT1KDM4EALDH1A1L3MBTL1RAB9A
SCHEMBL20730072 0.81 DGAT1 (0.56) DGAT1KDM4EL3MBTL1
SCHEMBL23309220 0.80 DGAT1 (0.55) DGAT1L3MBTL1
SCHEMBL10007447 0.79 DGAT1 (0.60) DGAT1
Potassium Ion SCHEMBL374697 0.79 DGAT1 (0.54) DGAT1L3MBTL1
SCHEMBL18541134 0.78 DGAT1 (0.62) DGAT1L3MBTL1RAB9A
SCHEMBL16661033 0.78 DGAT1 (0.62) DGAT1L3MBTL1MAPT
SCHEMBL23309284 0.78 DGAT1 (0.53) DGAT1KDM4EALDH1A1L3MBTL1MAPT
SCHEMBL13948727 0.78 CYP2C9 (0.46) DGAT1ALDH1A1CYP2C9L3MBTL1MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11365192-B2 Pyridine compound substituted with azole TAISHO PHARMACEUTICAL CO., LTD. (JP) 2022-06-21 US disclosed
US-20210122741-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE TAISHO PHARMACEUTICAL CO., LTD (JP) 2021-04-29 US disclosed
EP-3666766-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE Taisho Pharmaceutical Co., Ltd. (JP) 2020-06-17 EP disclosed
EP-2651915-B1 CONTINUOUS ARYCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2016-05-25 EP disclosed
WO-2012024179-A1 SUBSTITUTED AMIDE DERIVATIVES AS DGAT-1 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2012-02-23 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 (2 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-20210122741-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE CYP2C19, CYP4A11, CYP11B1 DGAT1 1601/4885P2RX3 1873/4885KDM4E 169/4885
US-11365192-B2 Pyridine compound substituted with azole CYP2C19, CYP4A11, CYP11B1 DGAT1 1601/4885P2RX3 1873/4885KDM4E 169/4885

“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.