SCHEMBL22261258

SCHEMBL22261258

CC(C)Oc1ncccc1CNc1nc(Cl)ncc1C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 16/20 0.63
▸ JAK2 O60674 5/20 0.50
▸ JAK1 P23458 5/20 0.47
▸ TYK2 P29597 3/20 0.42
▸ LIPG Q9Y5X9 1/20 0.42
▸ SYK P43405 1/20 0.41
▸ SLC13A5 Q86YT5 1/20 0.40

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
SCHEMBL22261332 0.89 JAK3 (0.61) JAK3JAK2JAK1TYK2
SCHEMBL22261319 0.88 JAK3 (0.63) JAK3JAK2JAK1TYK2
SCHEMBL22261390 0.86 JAK3 (0.63) JAK3JAK2JAK1TYK2
SCHEMBL22261177 0.85 JAK3 (0.62) JAK3JAK2JAK1TYK2SYK
SCHEMBL22261321 0.83 JAK3 (0.60) JAK3JAK2JAK1TYK2
SCHEMBL22261224 0.81 JAK3 (0.59) JAK3JAK2JAK1TYK2
SCHEMBL22261278 0.80 JAK3 (0.48) JAK3JAK2JAK1TYK2
SCHEMBL22261253 0.79 JAK3 (0.59) JAK3JAK2JAK1TYK2
SCHEMBL22261183 0.78 JAK3 (0.58) JAK3JAK2JAK1TYK2SYK
SCHEMBL22261044 0.78 JAK3 (0.59) JAK3JAK2JAK1TYK2

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 2 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
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
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