SCHEMBL18166111

SCHEMBL18166111

COc1ccc(C(=O)NCC(=O)N2CCC(CCc3c(N)nc(C)nc3Cl)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 8/20 0.59
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL19971866 0.89 MBOAT4 (0.70) MBOAT4MAPTL3MBTL1SMN1; SMN2
SCHEMBL19971856 0.86 MBOAT4 (0.75) MBOAT4
SCHEMBL18166216 0.86 MBOAT4 (0.75) MBOAT4
SCHEMBL19971863 0.85 MBOAT4 (0.58) MBOAT4KMT2ASMN1; SMN2
SCHEMBL18166110 0.84 MBOAT4 (0.57) MBOAT4ALDH1A1SMN1; SMN2
SCHEMBL18166212 0.84 MBOAT4 (0.55) MBOAT4LMNASMN1; SMN2
SCHEMBL18153984 0.84 MBOAT4 (0.64) MBOAT4LMNASMN1; SMN2
SCHEMBL19971810 0.83 MBOAT4 (0.81) MBOAT4ALDH1A1
SCHEMBL18166164 0.83 MBOAT4 (0.81) MBOAT4ALDH1A1
SCHEMBL19971783 0.81 MBOAT4 (0.53) MBOAT4SMN1; SMN2

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-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
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 1/4885KMT2A 1158/4885KDM4E 961/4885
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS MBOAT4, GIPR, PLAAT2 MBOAT4 1/4885KMT2A 1158/4885KDM4E 961/4885

“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.