SCHEMBL23901681

SCHEMBL23901681

Cc1cc(C2CCNCC2)nc2c(C(=O)NC(c3cccs3)C(F)(F)F)ncn12

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
MAP3K12 Q12852 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ITGB3 P05106 2/20 0.32
ITGA2B P08514 2/20 0.32
F2R P25116 1/20 0.32
LMNA P02545 1/20 0.31
PLAT P00750 1/20 0.30
PDE2A O00408 1/20 0.30
CCR5 P51681 1/20 0.30
TYRO3 Q06418 1/20 0.30
CNR2 P34972 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
SCHEMBL23901675 0.86 CNR2 (0.41) PIM1PIM3PIM2MAP3K12CNR2
SCHEMBL23901580 0.82 PKM (0.33) NPSR1PDE2ACNR2
SCHEMBL23901685 0.79 AHR (0.35) LMNA
SCHEMBL23901570 0.76 PIM1 (0.33) PIM1PIM3PIM2TYRO3CNR2
SCHEMBL23901466 0.68 DEGS1 (0.37) PIM1PIM3PIM2
SCHEMBL23901518 0.67 CYP2C9 (0.47) NPSR1LMNACNR2
SCHEMBL23901453 0.66 HCRTR2 (0.38) MAP3K12
SCHEMBL19437956 0.66 MAPK1 (0.38) PDE2A
SCHEMBL19438216 0.66 JAK2 (0.36) PDE2A
SCHEMBL19438040 0.65 KDM4E (0.37) LMNA

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 PIM1 151/4885PIM3 215/4885PIM2 174/4885

“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.