SCHEMBL18166114

SCHEMBL18166114

Cc1nc(N)c(CCC2CCN(C(=O)CN)CC2)c(Cl)n1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 12/20 0.66
CPN1 P15169 1/20 0.34
CPB2 Q96IY4 1/20 0.34
ROCK2 O75116 1/20 0.34
ROCK1 Q13464 1/20 0.34
OPRK1 P41145 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
FAAH O00519 1/20 0.32

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
SCHEMBL16699213 0.88 MBOAT4 (0.69) MBOAT4OPRK1FAAH
SCHEMBL18153984 0.87 MBOAT4 (0.64) MBOAT4OPRK1
SCHEMBL16728368 0.85 MBOAT4 (0.77) MBOAT4OPRK1FAAH
SCHEMBL19311928 0.84 MBOAT4 (0.76) MBOAT4OPRK1FNTAFNTB
SCHEMBL19971822 0.84 MBOAT4 (0.64) MBOAT4OPRK1FAAH
SCHEMBL19971821 0.84 MBOAT4 (0.64) MBOAT4OPRK1FAAH
SCHEMBL16698876 0.84 MBOAT4 (0.76) MBOAT4OPRK1FNTAFNTB
Hydrochloric Acid SCHEMBL16699518 0.83 MBOAT4 (0.74) MBOAT4OPRK1FNTAFNTB
Hydrochloric Acid SCHEMBL19971786 0.83 MBOAT4 (0.74) MBOAT4OPRK1FNTAFNTB
SCHEMBL16728370 0.83 MBOAT4 (0.74) MBOAT4OPRK1FAAH

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 7 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
WO-2016168225-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-10227310-B2 Ghrelin 0-acyl transferase inhibitors MBOAT4, GIPR, PLAAT2 MBOAT4 1/4885CPN1 1266/4885CPB2 2280/4885
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS MBOAT4, GIPR, PLAAT2 MBOAT4 1/4885CPN1 1266/4885CPB2 2280/4885

“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.