SCHEMBL27432005

SCHEMBL27432005

Cc1nc2cnc3[nH]ccc3c2n1C1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.61
JAK1 P23458 19/20 0.61
AURKA O14965 1/20 0.58
PRKCA P17252 1/20 0.58
KDR P35968 1/20 0.58
TYK2 P29597 4/20 0.55
JAK3 P52333 4/20 0.55

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
SCHEMBL2280497 0.94 JAK2 (0.66) JAK2JAK1AURKAPRKCAKDR
SCHEMBL2275731 0.90 JAK2 (0.59) JAK2JAK1AURKAPRKCAKDR
SCHEMBL2275734 0.90 JAK2 (0.59) JAK2JAK1AURKAPRKCAKDR
SCHEMBL2275727 0.90 JAK2 (0.59) JAK2JAK1AURKAPRKCAKDR
SCHEMBL27433394 0.89 JAK1 (0.60) JAK2JAK1TYK2JAK3
SCHEMBL25289131 0.88 JAK1 (0.66) JAK2JAK1TYK2JAK3
SCHEMBL29460632 0.88 JAK1 (0.66) JAK2JAK1TYK2JAK3
SCHEMBL25240987 0.88 JAK1 (0.66) JAK2JAK1TYK2JAK3
SCHEMBL9953265 0.85 JAK1 (0.53) JAK2JAK1AURKAPRKCAKDR
SCHEMBL2282018 0.84 JAK1 (0.54) JAK2JAK1AURKAPRKCAKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4393923-A1 PYRIDO RING COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE, COMPOSITION, AND APPLICATION Yiyou Biotech (Shanghai) Co., Ltd. (CN) 2024-07-03 EP disclosed