SCHEMBL31436648

SCHEMBL31436648

CNc1cc(Cl)ncc1C(=O)NC1CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 12/20 0.46
▸ HPGD P15428 2/20 0.46
▸ RAB9A P51151 1/20 0.43
▸ P2RX7 Q99572 1/20 0.42
▸ NR3C1 P04150 2/20 0.42
▸ LRRK2 Q5S007 2/20 0.41

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
SCHEMBL26598787 1.00 IRAK4 (0.46) IRAK4HPGDRAB9AP2RX7NR3C1
SCHEMBL31436626 0.87 IRAK4 (0.53) IRAK4HPGD
SCHEMBL26598727 0.87 IRAK4 (0.53) IRAK4HPGD
SCHEMBL31436632 0.85 IRAK4 (0.46) IRAK4HPGDRAB9ALRRK2
SCHEMBL26598650 0.85 IRAK4 (0.46) IRAK4HPGDRAB9ALRRK2
SCHEMBL31436622 0.85 IRAK4 (0.61) IRAK4
SCHEMBL26598605 0.85 IRAK4 (0.61) IRAK4
SCHEMBL26108232 0.83 IRAK4 (0.41) IRAK4
SCHEMBL26108220 0.83 IRAK4 (0.41) IRAK4
SCHEMBL30606157 0.82 HPGD (0.58) IRAK4HPGDRAB9AP2RX7NR3C1

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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