SCHEMBL23901467

SCHEMBL23901467

Cc1cc(C2CCOCC2)nc2c(C(=O)NC(=O)C(C)(C)C3CC3)ncn12

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 4/20 0.34
KDM5B Q9UGL1 1/20 0.32
RAF1 P04049 8/20 0.32
BRAF P15056 3/20 0.32
CNR2 P34972 1/20 0.31
MAPK1 P28482 1/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CB P42338 2/20 0.31
PIK3CG P48736 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
F2 P00734 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
SCHEMBL23901463 0.78 ALDH1A1 (0.39) MAPK1ALDH1A1HSD17B10
SCHEMBL23901591 0.75 RAB9A (0.43) MAPK1ALDH1A1HSD17B10
SCHEMBL23901524 0.75 IRAK4 (0.41) IRAK4RAF1MAPK1ALDH1A1HSD17B10
SCHEMBL23901521 0.73 CD38 (0.39)
SCHEMBL23901679 0.73 RAF1 (0.34) IRAK4RAF1CNR2PIK3CDPIK3CB
SCHEMBL23901553 0.72 TYRO3 (0.34) CNR2
SCHEMBL23901674 0.72 LMNA (0.38) IRAK4CNR2MAPK1ALDH1A1HSD17B10
SCHEMBL19452075 0.71 IRAK4 (0.36) IRAK4RAF1BRAFCNR2MAPK1
SCHEMBL23901677 0.71 L3MBTL1 (0.45) IRAK4MAPK1ALDH1A1HSD17B10
SCHEMBL23901684 0.70 CNR1 (0.38) CNR2MAPK1PIK3CDPIK3CBPIK3CG

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-20210309661-A1 IMIDAZO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2021-10-07 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-20210309661-A1 IMIDAZO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, GBA2 IRAK4 1349/4885KDM5B 542/4885RAF1 4065/4885

“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.