SCHEMBL31436626

SCHEMBL31436626

O=C(NC1CC1)c1cnc(Cl)cc1NC1CC1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 18/20 0.53
▸ HPGD P15428 2/20 0.47
▸ TNF P01375 2/20 0.45

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
SCHEMBL26598727 1.00 IRAK4 (0.53) IRAK4HPGDTNF
SCHEMBL15688740 0.89 IRAK4 (0.58) IRAK4TNF
SCHEMBL31678598 0.87 IRAK4 (0.48) IRAK4TNF
SCHEMBL26598787 0.87 IRAK4 (0.46) IRAK4HPGD
SCHEMBL31436648 0.87 IRAK4 (0.46) IRAK4HPGD
SCHEMBL21379216 0.85 IRAK4 (0.62) IRAK4TNF
SCHEMBL21389884 0.85 IRAK4 (0.62) IRAK4TNF
SCHEMBL30266640 0.85 IRAK4 (0.45) IRAK4HPGD
SCHEMBL31436651 0.85 CA1 (0.45) IRAK4
SCHEMBL4404049 0.85 CA1 (0.45) IRAK4

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
CN-119585250-A KIT inhibitors 蓝图药品公司 2025-03-07 — — CN disclosed
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