SCHEMBL27696134

SCHEMBL27696134

O=CC1c2ccccc2C(O)=NN1c1ccc(I)cc1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.30
▸ HSP90AA1 P07900 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ ATM Q13315 1/20 0.30
▸ TLR9 Q9NR96 1/20 0.30

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
SCHEMBL27756554 0.84 DHODH (0.36) MEN1KMT2A
SCHEMBL27696136 0.72 EGFR (0.35) MEN1HSP90AA1KMT2AATM
SCHEMBL29089072 0.71 KDM4E (0.33) —
SCHEMBL27696148 0.71 PTGS2 (0.32) MEN1KMT2A
SCHEMBL27696135 0.69 LMNA (0.36) —
SCHEMBL27696143 0.69 DHODH (0.36) —
SCHEMBL27696130 0.69 PDE5A (0.36) MEN1KMT2A
SCHEMBL27696153 0.68 MEN1 (0.43) MEN1HSP90AA1KMT2AATMTLR9
SCHEMBL27677532 0.67 PTGS2 (0.30) —
SCHEMBL27745788 0.63 GAA (0.39) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101027290-B 2, 3-phthalazinone derivatives as AURORA-a kinase inhibitors HOFFMANN LA ROCHE 2010-05-12 — — CN disclosed
CN-101405001-A Methods of inhibiting BTK and SYK protein kinases HOFFMANN LA ROCHE (CH) 2009-04-08 — — CN disclosed
CN-101027290-A Novel 2,3-phthalazinone derivatives, as AURORA-A kinase inhibitors HOFFMANN LA ROCHE (CH) 2007-08-29 — — CN disclosed
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