SCHEMBL23901581

SCHEMBL23901581

CCCOC1CCC(C(NC(=O)c2ncn3c(C)cc(Cl)nc23)C(F)(F)F)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 3/20 0.32
CBLB Q13191 1/20 0.32
ULK1 O75385 1/20 0.30
ULK2 Q8IYT8 1/20 0.30
MKNK2 Q9HBH9 1/20 0.30
STK17A Q9UEE5 1/20 0.30
MAPK1 P28482 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
SCHEMBL19437919 0.89 ULK1 (0.35) ULK1ULK2MKNK2STK17AMAPK1
SCHEMBL19437920 0.89 ULK1 (0.35) ULK1ULK2MKNK2STK17AMAPK1
SCHEMBL19438108 0.89 ULK1 (0.35) ULK1ULK2MKNK2STK17AMAPK1
SCHEMBL23901683 0.84 CD38 (0.35) MAPK1
SCHEMBL19438038 0.81 ACACB (0.35) ACACBULK1ULK2MKNK2STK17A
SCHEMBL19438216 0.80 JAK2 (0.36) ULK1ULK2MKNK2STK17AMAPK1
SCHEMBL19438295 0.78 JAK2 (0.39) ULK1ULK2MKNK2STK17AMAPK1
SCHEMBL19449590 0.78 ULK1 (0.34) ULK1ULK2MKNK2STK17AMAPK1
SCHEMBL19449397 0.78 PDE2A (0.36) ULK1ULK2MKNK2STK17AMAPK1
SCHEMBL19438052 0.78 RORC (0.34) ACACBULK1ULK2MKNK2STK17A

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 ACACB 2039/4885CBLB 2558/4885ULK1 1040/4885

“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.