SCHEMBL19984155

SCHEMBL19984155

Cc1nc(Cl)nc(N)c1C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.38
LMNA P02545 1/20 0.37
IDO1 P14902 2/20 0.36
CDK1 P06493 1/20 0.35
ALDH1A1 P00352 3/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
KDM4E B2RXH2 1/20 0.33
HTT P42858 2/20 0.32
ADRA2A P08913 1/20 0.32
ADORA2A P29274 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CSNK1A1 P48729 1/20 0.30
CLK4 Q9HAZ1 1/20 0.30

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
SCHEMBL14864520 0.86 PDE10A (0.41) PDE10ALMNAIDO1CDK1ALDH1A1
SCHEMBL1586433 0.80 ALDH1A1 (0.47) PDE10ALMNAALDH1A1ALOX15TSHR
SCHEMBL6474069 0.79 CDK1 (0.35) LMNAIDO1CDK1ALDH1A1ALOX15
SCHEMBL19754271 0.79 IDO1 (0.41) LMNAIDO1CDK1ALDH1A1ALOX15
SCHEMBL10603143 0.79 PDE10A (0.52) PDE10ALMNAIDO1CDK1ALDH1A1
SCHEMBL30696400 0.77 LMNA (0.52) LMNAIDO1CDK1ALDH1A1ALOX15
SCHEMBL11775855 0.77 LMNA (0.52) LMNAIDO1CDK1ALDH1A1ALOX15
SCHEMBL18153980 0.75 CDK1 (0.33) LMNAIDO1CDK1ALDH1A1ALOX15
SCHEMBL18913381 0.75 CDK1 (0.33) LMNAIDO1CDK1ALDH1A1ALOX15
SCHEMBL18520396 0.75 ALDH1A1 (0.41) LMNAIDO1CDK1ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3134411-B1 PURINE DERIVATIVES AS CD73 INHIBITORS FOR THE TREATMENT OF CANCER BOEHRINGER INGELHEIM INT (DE) 2021-06-30 EP 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

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 PDE10A 1516/4885LMNA 4700/4885IDO1 1545/4885
US-20180079729-A1 GHRELIN 0-ACYL TRANSFERASE INHIBITORS MBOAT4, GIPR, PLAAT2 PDE10A 1516/4885LMNA 4700/4885IDO1 1545/4885

“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.