SCHEMBL30956597

SCHEMBL30956597

O=C(O)c1cccc(-c2ccnc(Nc3cnn(C4CC4)c3)n2)c1F

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 13/20 0.49
JAK2 O60674 11/20 0.49
JAK1 P23458 10/20 0.49
LRRK2 Q5S007 3/20 0.47
CLK2 P49760 1/20 0.47
TYK2 P29597 4/20 0.44
ACVR1 Q04771 2/20 0.43
IKBKE Q14164 2/20 0.43
TBK1 Q9UHD2 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
SCHEMBL30956528 0.90 JAK3 (0.48) JAK3JAK2JAK1LRRK2CLK2
SCHEMBL30956497 0.85 JAK3 (0.54) JAK3JAK2JAK1LRRK2CLK2
SCHEMBL30956536 0.83 JAK3 (0.56) JAK3JAK2JAK1LRRK2CLK2
SCHEMBL30956568 0.83 JAK3 (0.50) JAK3JAK2JAK1LRRK2CLK2
SCHEMBL30956565 0.83 JAK3 (0.51) JAK3JAK2JAK1LRRK2CLK2
SCHEMBL22097812 0.81 IKBKE (0.53) JAK3JAK2JAK1LRRK2TYK2
SCHEMBL31557679 0.81 IKBKE (0.53) JAK3JAK2JAK1LRRK2TYK2
SCHEMBL30956377 0.79 JAK3 (0.51) JAK3JAK2JAK1TYK2IKBKE
SCHEMBL30956373 0.76 JAK3 (0.53) JAK3JAK2JAK1LRRK2TYK2
SCHEMBL30956553 0.76 CDK1 (0.56) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119118999-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-12-13 CN disclosed
CN-118955477-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-15 CN disclosed
CN-118903141-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-08 CN disclosed
CN-118903142-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-08 CN disclosed
CN-113227074-B Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-08-16 CN disclosed
CN-118388457-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-26 CN disclosed
CN-118290403-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-05 CN disclosed