SCHEMBL21189606

SCHEMBL21189606

CCOC(=O)c1nc(Cl)n2nc(C)cc2n1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ADORA2A P29274 1/20 0.42
ADORA3 P0DMS8 2/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
BAZ2B Q9UIF8 1/20 0.39
BAZ2A Q9UIF9 1/20 0.39

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
SCHEMBL25465514 0.81 CYP1A2 (0.45) KMT2ASMN1; SMN2KDM4EALDH1A1TP53
SCHEMBL21177423 0.78 KDM4E (0.45) KMT2ASMN1; SMN2ADORA2AKDM4EALDH1A1
SCHEMBL28790800 0.77 PDE4A (0.43) KMT2ASMN1; SMN2KDM4EALDH1A1TP53
SCHEMBL9679763 0.76 ADORA3 (0.47) KMT2AADORA2AADORA3ALDH1A1
SCHEMBL31001796 0.75 KDM4E (0.48) KMT2ASMN1; SMN2ADORA2AADORA3KDM4E
SCHEMBL20064712 0.74 GAA (0.48) KMT2ASMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL3607532 0.74 ADORA2A (0.49) KMT2ASMN1; SMN2ADORA2AADORA3KDM4E
SCHEMBL21177165 0.73 KDM4E (0.46) KMT2ASMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL5066763 0.73 POLB (0.45) KMT2ASMN1; SMN2ADORA3KDM4EALDH1A1
SCHEMBL1298563 0.73 MAPK1 (0.57) KMT2ASMN1; SMN2KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-05-16 US disclosed
US-20230124394-A1 PI4KIIIBETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-04-20 US disclosed
US-20210387988-A1 PI4KIIIbeta Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-12-16 US disclosed
WO-2019141694-A1 PI4KIIIBETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-07-25 WO 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-20230124394-A1 PI4KIIIBETA INHIBITORS PI4KB, PI4K2B, PI4K2A KMT2A 1239/4885SMN1; SMN2 4317/4885ADORA2A 2814/4885
US-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors PI4K2A, PI4K2B, PI4KA KMT2A 1679/4885SMN1; SMN2 4271/4885ADORA2A 981/4885
US-20210387988-A1 PI4KIIIbeta Inhibitors PI4KB, PI4K2B, PI4K2A KMT2A 1237/4885SMN1; SMN2 4375/4885ADORA2A 2726/4885

“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.