SCHEMBL29136798

SCHEMBL29136798

CC1C(c2cccc(Cl)c2)[C@H]1C(=O)Nc1cc(NCc2cn3cc(C4CC4)ccc3n2)ncn1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 18/20 0.41
▸ METTL3 Q86U44 1/20 0.40
▸ DGAT1 O75907 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
SCHEMBL29880266 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL29879162 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL29879204 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL29136795 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL29879428 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL24737981 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL29879418 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL29136925 1.00 KLKB1 (0.41) KLKB1METTL3DGAT1
SCHEMBL24737670 0.91 DGAT1 (0.41) KLKB1METTL3DGAT1
SCHEMBL29879731 0.91 DGAT1 (0.41) KLKB1METTL3DGAT1

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-117355521-A Heteroaryl inhibitors of plasma kallikrein 武田药品工业株式会社 2024-01-05 — — CN disclosed
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