SCHEMBL31364639

SCHEMBL31364639

CC(C)(CNc1ncnc2c(Cl)nc(N)cc12)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AURKA O14965 11/20 0.37
RPS6KB1 P23443 11/20 0.37
AURKB Q96GD4 3/20 0.37
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
EGFR P00533 4/20 0.33
PDE5A O76074 4/20 0.32

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
SCHEMBL31364649 0.87 JAK2 (0.46) AURKARPS6KB1AURKBJAK2JAK1
SCHEMBL31364671 0.85 JAK2 (0.38) AURKARPS6KB1AURKBJAK2JAK1
SCHEMBL31364657 0.77 AURKA (0.40) AURKARPS6KB1AURKBEGFR
SCHEMBL31364650 0.74 JAK2 (0.48) JAK2JAK1EGFRPDE5A
SCHEMBL31364618 0.73 JAK2 (0.47) JAK2JAK1EGFRPDE5A
SCHEMBL19762902 0.68 JAK2 (0.47) AURKARPS6KB1AURKBJAK2JAK1
SCHEMBL31364640 0.64 AURKA (0.42) AURKARPS6KB1AURKBJAK2JAK1
SCHEMBL31364613 0.62 JAK2 (0.43) JAK2JAK1EGFRPDE5A
SCHEMBL15719617 0.61 RAB9A (0.49) EGFR
SCHEMBL4954568 0.61 GALR3 (0.52) JAK2JAK1

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
WO-2025020886-A1 AZAQUINAZOLINE RING DERIVATIVE AND USE THEREOF 浙江星浩澎博医药有限公司 2025-01-30 WO disclosed