SCHEMBL18153613

SCHEMBL18153613

Cc1nc(C(F)(F)F)nc(N)c1C#CC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
GPR119 Q8TDV5 12/20 0.37
STS P08842 1/20 0.36
HDAC4 P56524 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 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
SCHEMBL20009390 0.87 GPR119 (0.44) KDM4EMAPTTHRBGPR119HPGD
SCHEMBL18166161 0.85 MAPT (0.40) KDM4EMAPTTHRBGPR119STS
SCHEMBL16698699 0.79 GPR119 (0.42) MBOAT4KDM4EMAPTTHRBGPR119
SCHEMBL19991495 0.76 MBOAT4 (0.65) MBOAT4KDM4EGPR119
SCHEMBL16049455 0.73 MAP4K4 (0.44) KDM4EMAPTTHRBGPR119STS
SCHEMBL25258371 0.72 GPR119 (0.44) MAPTGPR119STSMEN1KMT2A
SCHEMBL29774310 0.72 GPR119 (0.44) KDM4EMAPTTHRBGPR119
SCHEMBL20839829 0.72 GPR119 (0.44) KDM4EMAPTTHRBGPR119
SCHEMBL30381534 0.72 HPGD (0.49) KDM4EMAPTTHRBGPR119STS
SCHEMBL22776493 0.72 GPR119 (0.45) KDM4EGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428723-B Ghrelin O-acyltransferase inhibitors 伊莱利利公司 2020-05-05 CN disclosed
EP-3283473-B1 GHRELIN O-ACYL TRANSFERASE INHIBITORS LILLY CO ELI (US) 2019-01-02 EP disclosed
EP-3283473-B1 GHRELIN O-ACYL TRANSFERASE INHIBITORS LILLY CO ELI (US) 2019-01-02 EP disclosed
US-10093651-B2 Ghrelin O-acyl transferase inhibitors ELI LILLY AND COMPANY (US) 2018-10-09 US disclosed
US-20180086732-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY 2018-03-29 US disclosed
US-20180086732-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY 2018-03-29 US disclosed
EP-3283473-A1 GHRELIN O-ACYL TRANSFERASE INHIBITORS Eli Lilly and Company (US) 2018-02-21 EP disclosed
WO-2016168222-A1 GHRELIN O-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY (US) 2016-10-20 WO disclosed
WO-2016168222-A1 GHRELIN O-ACYL TRANSFERASE INHIBITORS ELI LILLY AND COMPANY (US) 2016-10-20 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-20180086732-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS MBOAT4, GIPR, PLAAT2 MBOAT4 1/4885KDM4E 961/4885MAPT 1378/4885
US-10093651-B2 Ghrelin O-acyl transferase inhibitors MBOAT4, GIPR, DGAT1 MBOAT4 1/4885KDM4E 926/4885MAPT 1541/4885

“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.