SCHEMBL16698699

SCHEMBL16698699

Cc1nc(N)c(C#CC2CCN(C(=O)OC(C)(C)C)CC2)c(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.42
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
THRB P10828 1/20 0.38
MBOAT4 Q96T53 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HPGD P15428 1/20 0.37
HPGDS O60760 1/20 0.37
POLB P06746 1/20 0.36
STS P08842 2/20 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
SCHEMBL20009390 0.89 GPR119 (0.44) GPR119MAPTKDM4ETHRBHPGD
SCHEMBL18166161 0.85 MAPT (0.40) GPR119MAPTKDM4ETHRBHPGD
SCHEMBL16698894 0.84 MBOAT4 (0.38) MBOAT4
SCHEMBL16049455 0.83 MAP4K4 (0.44) GPR119MAPTKDM4ETHRBHPGDS
SCHEMBL18153613 0.79 MBOAT4 (0.39) GPR119MAPTKDM4ETHRBMBOAT4
SCHEMBL25258371 0.78 GPR119 (0.44) GPR119MAPTMEN1KMT2APOLB
SCHEMBL19971864 0.78 GRM5 (0.46) GPR119MEN1KMT2APOLB
SCHEMBL16078096 0.77 MAP4K4 (0.44) GPR119MAPTKDM4ETHRB
SCHEMBL31605066 0.77 GPR119 (0.42) GPR119MEN1KMT2AHPGDHPGDS
SCHEMBL16040735 0.76 GPR119 (0.40) GPR119MAPTKDM4ETHRBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107454898-B Ghrelin O-acyltransferase inhibitors 伊莱利利公司 2020-05-05 CN disclosed
US-10227310-B2 Ghrelin 0-acyl transferase inhibitors ELI LILLY AND COMPANY (US) 2019-03-12 US disclosed
US-10227310-B2 Ghrelin 0-acyl transferase inhibitors ELI LILLY AND COMPANY (US) 2019-03-12 US disclosed
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY 2018-03-22 US disclosed
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY 2018-03-22 US disclosed
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY 2018-03-22 US disclosed
EP-3068775-B1 SUBSTITUTED PIPERIDYL-ETHYL-PYRIMIDINE AS GHRELIN O-ACYL TRANSFERASE INHIBITOR LILLY CO ELI (US) 2017-09-06 EP disclosed
EP-3068775-B1 SUBSTITUTED PIPERIDYL-ETHYL-PYRIMIDINE AS GHRELIN O-ACYL TRANSFERASE INHIBITOR LILLY CO ELI (US) 2017-09-06 EP disclosed
WO-2016168225-A1 GHRELIN O-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY (US) 2016-10-20 WO disclosed
EP-3068775-A1 SUBSTITUTED PIPERIDYL-ETHYL-PYRIMIDINE AS GHRELIN O-ACYL TRANSFERASE INHIBITOR Eli Lilly and Company (US) 2016-09-21 EP disclosed
WO-2015073281-A1 SUBSTITUTED PIPERIDYL-ETHYL-PYRIMIDINE AS GHRELIN O-ACYL TRANSFERASE INHIBITOR ELI LILLY AND COMPANY (US) 2015-05-21 WO disclosed
WO-2015073281-A1 SUBSTITUTED PIPERIDYL-ETHYL-PYRIMIDINE AS GHRELIN O-ACYL TRANSFERASE INHIBITOR ELI LILLY AND COMPANY (US) 2015-05-21 WO disclosed
US-9035051-B1 Ghrelin O-acyl transferase inhibitor ELI LILLY AND COMPANY (US) 2015-05-19 US disclosed
US-9035051-B1 Ghrelin O-acyl transferase inhibitor ELI LILLY AND COMPANY (US) 2015-05-19 US disclosed
US-9035051-B1 Ghrelin O-acyl transferase inhibitor ELI LILLY AND COMPANY (US) 2015-05-19 US disclosed
US-20150133474-A1 GHRELIN O-ACYL TRANSFERASE INHIBITOR ELI LILLY AND COMPANY 2015-05-14 US disclosed
US-20150133474-A1 GHRELIN O-ACYL TRANSFERASE INHIBITOR ELI LILLY AND COMPANY 2015-05-14 US disclosed
US-20150133474-A1 GHRELIN O-ACYL TRANSFERASE INHIBITOR ELI LILLY AND COMPANY 2015-05-14 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 (3 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-10227310-B2 Ghrelin 0-acyl transferase inhibitors MBOAT4, GIPR, PLAAT2 GPR119 18/4885MAPT 1378/4885KDM4E 961/4885
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS MBOAT4, GIPR, PLAAT2 GPR119 18/4885MAPT 1378/4885KDM4E 961/4885
US-20150133474-A1 GHRELIN O-ACYL TRANSFERASE INHIBITOR MBOAT4, DGAT1, MOGAT2 GPR119 24/4885MAPT 1343/4885KDM4E 913/4885

“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.