SCHEMBL23901593

SCHEMBL23901593

Cc1cc(-c2cccnc2)nc2c(C(=O)NCCc3ccc(-c4cnco4)cc3)ncn12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 3/20 0.42
PTGDR Q13258 1/20 0.37
TP53 P04637 2/20 0.37
KMT2A Q03164 2/20 0.36
EGLN1 Q9GZT9 1/20 0.36
MAPT P10636 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ADRB3 P13945 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CDK2 P24941 1/20 0.36
GSK3B P49841 1/20 0.36
PTGFR P43088 1/20 0.35

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
SCHEMBL23901676 0.84 TRPV1 (0.43) TP53KMT2AEGLN1MAPTKDM4E
SCHEMBL23901592 0.83 KMT2A (0.44) PTGDRTP53KMT2AMAPTNPC1
SCHEMBL23901678 0.81 LMNA (0.38) PTGIRTP53ALDH1A1RAB9ASMN1; SMN2
SCHEMBL23901594 0.81 ALDH1A1 (0.42) PTGIRTP53MAPTKDM4EALDH1A1
SCHEMBL23901590 0.80 TP53 (0.40) PTGIRPTGDRTP53KMT2AMAPT
SCHEMBL23901682 0.78 CRHR1 (0.44) TP53NAMPT
SCHEMBL22472783 0.76 ALDH1A1 (0.44) TP53KMT2AMAPTCA12CA1
SCHEMBL19449609 0.75 DYRK1A (0.47) KMT2AEGLN1KDM4EALDH1A1MEN1
SCHEMBL23901595 0.73 CRHR1 (0.38) TP53KMT2AEGLN1MAPTKDM4E
SCHEMBL19438303 0.73 KDM4E (0.46) KDM4EALDH1A1

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 PTGIR 1510/4885PTGDR 1721/4885TP53 3352/4885

“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.