SCHEMBL18166117

SCHEMBL18166117

Cc1nc(N)c(CCC2CCCN(C(=O)OC(C)(C)C)CC2)c(Cl)n1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 8/20 0.59
BACE1 P56817 3/20 0.41
CTSD P07339 1/20 0.41
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
FAAH O00519 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
DPP4 P27487 1/20 0.38
GLS O94925 1/20 0.38

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
SCHEMBL28406437 1.00 MBOAT4 (0.59) MBOAT4BACE1CTSDKDM4EPKM
SCHEMBL28406440 1.00 MBOAT4 (0.59) MBOAT4BACE1CTSDKDM4EPKM
SCHEMBL16699034 0.96 MBOAT4 (0.63) MBOAT4KDM4EPKMFAAHGPR119
SCHEMBL19971822 0.86 MBOAT4 (0.64) MBOAT4FAAH
SCHEMBL19971821 0.86 MBOAT4 (0.64) MBOAT4FAAH
SCHEMBL18166194 0.85 MBOAT4 (0.80) MBOAT4
SCHEMBL19971797 0.85 MBOAT4 (0.80) MBOAT4
SCHEMBL19971798 0.85 MBOAT4 (0.80) MBOAT4
SCHEMBL20009391 0.85 MBOAT4 (0.50) MBOAT4KDM4EPKMFAAHGPR119
SCHEMBL16699845 0.84 MBOAT4 (0.49) MBOAT4BACE1KDM4EPKMFAAH

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-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
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 1/4885BACE1 1257/4885CTSD 2104/4885
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS MBOAT4, GIPR, PLAAT2 MBOAT4 1/4885BACE1 1257/4885CTSD 2104/4885

“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.