SCHEMBL24374650

SCHEMBL24374650

Cn1cc(B(O)O)cc(Nc2ccccn2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK10 P53779 1/20 0.44
GFER P55789 1/20 0.44
BTK Q06187 2/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
BRD4 O60885 2/20 0.38
TYK2 P29597 1/20 0.37
SHMT2 P34897 2/20 0.37
SYK P43405 1/20 0.36
TP53 P04637 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
PKM P14618 1/20 0.36
LYN P07948 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
SCHEMBL105801 0.80 MEN1 (0.47) MEN1KMT2AMAPK10GFERBTK
SCHEMBL29742044 0.80 MEN1 (0.47) MEN1KMT2AMAPK10GFERBTK
SCHEMBL24374771 0.77 BTK (0.39) BTK
SCHEMBL28380307 0.75 BTK (0.52) BTK
SCHEMBL173589 0.74 MEN1 (0.58) MEN1KMT2AMAPK10GFERBTK
SCHEMBL29741917 0.72 MEN1 (0.39) MEN1KMT2AMAPK10GFERBTK
SCHEMBL14925959 0.72 MEN1 (0.39) MEN1KMT2AMAPK10GFERBTK
SCHEMBL5130622 0.71 BTK (0.46) BTKBRD4
SCHEMBL4185338 0.70 BTK (0.46) BTKTYK2
SCHEMBL161634 0.69 MEN1 (0.47) MEN1KMT2AMAPK10GFERBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230043030-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2023-02-09 US disclosed
US-11478474-B2 2-(3′-(hydroxymethyl)-1-methyl-5-((5-(2-methyl-4-(oxetan-3-yl)piperazin-1-yl)pyridin-2-yl)amino)-6-oxo-1,6-dihydro-[3,4′-bipyridin]-2′-yl)-7,7-dimethyl-7,8-dihydro-2H-cyclopenta[4,5]pyrrolo[1,2-a]pyrazin-1(6H)-one as a BTK inhibitor HUTCHISON MEDIPHARMA LIMITED (CN) 2022-10-25 US disclosed
US-20220125785-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2022-04-28 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 (3 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-20220125785-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF CYP3A4, CYP4B1, CYP3A5 MEN1 1784/4885KMT2A 4098/4885MAPK10 4286/4885
US-11478474-B2 2-(3′-(hydroxymethyl)-1-methyl-5-((5-(2-methyl-4-(oxetan-3-yl)piperazin-1-yl)pyridin-2-yl)amino)-6-oxo-1,6-dihydro-[3,4′-bipyridin]-2′-yl)-7,7-dimethyl-7,8-dihydro-2H-cyclopenta[4,5]pyrrolo[1,2-a]pyrazin-1(6H)-one as a BTK inhibitor BTK, SYK, LCK MEN1 4013/4885KMT2A 639/4885MAPK10 590/4885
US-20230043030-A1 HETEROARYL HETEROCYCLIC COMPOUNDS AND USES THEREOF CYP3A43, CYP3A5, CYP11B2 MEN1 380/4885KMT2A 3208/4885MAPK10 4641/4885

“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.