SCHEMBL31359352

SCHEMBL31359352

Cc1ccc(C(N)=O)cc1NCc1cncc(-c2ncccn2)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DDR2 Q16832 7/20 0.53
▸ DDR1 Q08345 6/20 0.53
▸ HDAC8 Q9BY41 4/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ JAK2 O60674 1/20 0.43
▸ VNN1 O95497 2/20 0.42
▸ MAPK14 Q16539 1/20 0.41
▸ PTK2 Q05397 1/20 0.41
▸ JAK3 P52333 1/20 0.40
▸ IRAK4 Q9NWZ3 1/20 0.40
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39

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
SCHEMBL29933875 0.90 HDAC8 (0.49) DDR2DDR1HDAC8HDAC1HDAC6
SCHEMBL28884708 0.90 HDAC8 (0.49) DDR2DDR1HDAC8HDAC1HDAC6
SCHEMBL28884674 0.88 DDR1 (0.47) DDR2DDR1HDAC8HDAC1HDAC6
SCHEMBL31359386 0.88 HDAC8 (0.57) DDR2DDR1HDAC8HDAC1HDAC6
SCHEMBL29935081 0.79 DDR1 (0.44) DDR2DDR1HDAC8HDAC1HDAC6
SCHEMBL31359341 0.79 MKNK1 (0.46) MKNK1MKNK2
SCHEMBL31359374 0.78 MKNK1 (0.38) DDR2DDR1VNN1PTK2MKNK1
SCHEMBL31359360 0.76 HDAC8 (0.53) DDR2DDR1HDAC8HDAC1HDAC6
SCHEMBL29934245 0.75 HDAC1 (0.43) DDR2DDR1HDAC8HDAC1HDAC6
SCHEMBL29934033 0.75 VNN1 (0.51) DDR2DDR1HDAC8HDAC1HDAC6

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
CN-119371371-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2025-01-28 — — CN disclosed
CN-115315421-B Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2024-12-03 — — CN disclosed
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