SCHEMBL22261237

SCHEMBL22261237

COc1ccc(Cl)cc1CNc1nc(Cl)ncc1C(N)=O

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 9/20 0.65
JAK2 O60674 5/20 0.65
JAK1 P23458 4/20 0.65
TYK2 P29597 1/20 0.48
AURKA O14965 2/20 0.48
RPS6KB1 P23443 2/20 0.48
ADORA2A P29274 3/20 0.47
ADORA3 P0DMS8 3/20 0.47
STAT6 P42226 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
ADORA1 P30542 2/20 0.45
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
CSF1R P07333 2/20 0.43

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
SCHEMBL22261195 0.90 JAK3 (0.62) JAK3JAK2JAK1TYK2AURKA
SCHEMBL29622867 0.90 JAK3 (0.62) JAK3JAK2JAK1TYK2AURKA
SCHEMBL20844421 0.87 JAK3 (0.62) JAK3JAK2JAK1TYK2AURKA
SCHEMBL29622880 0.87 JAK3 (0.62) JAK3JAK2JAK1TYK2AURKA
SCHEMBL22261255 0.85 JAK3 (0.53) JAK3JAK2JAK1AURKARPS6KB1
SCHEMBL29622879 0.84 JAK3 (0.61) JAK3JAK2JAK1AURKARPS6KB1
SCHEMBL22261200 0.84 JAK3 (0.61) JAK3JAK2JAK1AURKARPS6KB1
SCHEMBL22261338 0.83 JAK3 (0.63) JAK3JAK2JAK1AURKARPS6KB1
SCHEMBL22261376 0.83 JAK3 (0.63) JAK3JAK2JAK1TYK2AURKA
SCHEMBL22261187 0.82 JAK3 (0.62) JAK3JAK2JAK1TYK2AURKA

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
EP-3686197-B1 2-SUBSTITUTED PYRAZOLE AMINO-4-SUBSTITUTED AMINO-5-PYRIMIDINE FORMAMIDE COMPOUND, COMPOSITION, AND APPLICATION THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2023-06-21 EP disclosed
US-11344549-B2 2-substituted pyrazole amino-4-substituted amino-5-pyrimidine formamide compound, composition, and application thereof BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2022-05-31 US disclosed
US-20210077489-A1 2-SUBSTITUTED PYRAZOLE AMINO-4-SUBSTITUTED AMINO-5-PYRIMIDINE FORMAMIDE COMPOUND, COMPOSITION, AND APPLICATION THEREOF BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2021-03-18 US disclosed
EP-3686197-A1 2-SUBSTITUTED PYRAZOLE AMINO-4-SUBSTITUTED AMINO-5-PYRIMIDINE FORMAMIDE COMPOUND, COMPOSITION, AND APPLICATION THEREOF Beijing Scitech-MQ Pharmaceuticals Limited (CN) 2020-07-29 EP 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 (2 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-20210077489-A1 2-SUBSTITUTED PYRAZOLE AMINO-4-SUBSTITUTED AMINO-5-PYRIMIDINE FORMAMIDE COMPOUND, COMPOSITION, AND APPLICATION THEREOF JAK1, JAK3, JAK2 JAK3 2/4885JAK2 3/4885JAK1 1/4885
US-11344549-B2 2-substituted pyrazole amino-4-substituted amino-5-pyrimidine formamide compound, composition, and application thereof JAK1, JAK3, JAK2 JAK3 2/4885JAK2 3/4885JAK1 1/4885

“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.