SCHEMBL19971866

SCHEMBL19971866

Cc1nc(N)c(CCC2CCN(C(=O)CNC(=O)c3ccncc3)CC2)c(Cl)n1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 12/20 0.70
SMN1; SMN2 Q16637 1/20 0.43
LDHA P00338 1/20 0.41
PREP P48147 2/20 0.41
DPP4 P27487 1/20 0.41
FAP Q12884 1/20 0.41
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
MAPT P10636 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL19971863 0.91 MBOAT4 (0.58) MBOAT4SMN1; SMN2LDHAPREP
SCHEMBL18166110 0.90 MBOAT4 (0.57) MBOAT4SMN1; SMN2LDHAPREPDPP4
SCHEMBL18166111 0.89 MBOAT4 (0.59) MBOAT4SMN1; SMN2MAPTL3MBTL1
SCHEMBL18166212 0.86 MBOAT4 (0.55) MBOAT4SMN1; SMN2LDHA
SCHEMBL18153984 0.86 MBOAT4 (0.64) MBOAT4SMN1; SMN2LDHA
SCHEMBL18166171 0.85 MBOAT4 (0.93) MBOAT4PREPFAPDPP8DPP9
SCHEMBL19971805 0.85 MBOAT4 (0.93) MBOAT4PREPFAPDPP8DPP9
SCHEMBL19971783 0.84 MBOAT4 (0.53) MBOAT4SMN1; SMN2LDHA
SCHEMBL19984463 0.82 MBOAT4 (1.00) MBOAT4PREPFAPDPP8DPP9
SCHEMBL19971780 0.82 MBOAT4 (1.00) MBOAT4PREPFAPDPP8DPP9

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-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

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 1/4885SMN1; SMN2 4346/4885LDHA 3446/4885
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS MBOAT4, GIPR, PLAAT2 MBOAT4 1/4885SMN1; SMN2 4346/4885LDHA 3446/4885

“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.