SCHEMBL26286178

SCHEMBL26286178

O=c1c2cc(-c3ccc(Cl)cc3)nc(-c3cccnc3)c2ncn1[C@H]1CCNC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 8/20 0.40
HTR6 P50406 3/20 0.40
BRD4 O60885 1/20 0.37
PSD A5PKW4 3/20 0.37
CLK1 P49759 1/20 0.36
DYRK1A Q13627 1/20 0.36
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
MAPK14 Q16539 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34

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
SCHEMBL25463926 0.86 CLK1 (0.41) PIM1PSDCLK1DYRK1AADORA2A
SCHEMBL23925576 0.86 CLK1 (0.41) PIM1PSDCLK1DYRK1AADORA2A
SCHEMBL23925577 0.86 CLK1 (0.41) PIM1PSDCLK1DYRK1AADORA2A
SCHEMBL23416866 0.84 MTOR (0.41) PSDCLK1DYRK1AADORA2AADORA1
SCHEMBL26280652 0.84 MTOR (0.41) PSDCLK1DYRK1AADORA2AADORA1
SCHEMBL23950535 0.84 CLK1 (0.38) PIM1PSDCLK1DYRK1AADORA2A
SCHEMBL25463141 0.84 CLK1 (0.38) PIM1PSDCLK1DYRK1AADORA2A
SCHEMBL23950537 0.84 CLK1 (0.38) PIM1PSDCLK1DYRK1AADORA2A
SCHEMBL23950775 0.84 MAPK14 (0.44) PIM1HTR6BRD4CLK1DYRK1A
SCHEMBL23390140 0.84 KCNH2 (0.41) PIM1PSDADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295152-A1 PYRIDOPYRIMIDINONE DERIVATIVES AS AHR ANTAGONISTS SENDA BIOSCIENCES, INC. (US) 2023-09-21 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 (1 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-20230295152-A1 PYRIDOPYRIMIDINONE DERIVATIVES AS AHR ANTAGONISTS AHR, ARNT, AIPL1 PIM1 2854/4885HTR6 392/4885BRD4 1249/4885

“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.