SCHEMBL24914819

SCHEMBL24914819

O=c1c2c(c3cccnc3n1Cc1ccc(Cl)cc1)CCN(Cc1cccc(Br)c1)C2

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 14/20 0.54
▸ ENPP2 Q13822 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ CYP3A4 P08684 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ DDB1 Q16531 1/20 0.42
▸ CRBN Q96SW2 1/20 0.42
▸ THRB P10828 1/20 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
SCHEMBL30130060 1.00 CLPP (0.54) CLPPENPP2TP53CYP3A4MAPT
SCHEMBL24914820 0.94 CLPP (0.56) CLPPENPP2CYP3A4MAPTDDB1
SCHEMBL30130064 0.94 CLPP (0.56) CLPPENPP2CYP3A4MAPTDDB1
SCHEMBL30130092 0.94 CLPP (0.61) CLPPENPP2MAPTDDB1CRBN
SCHEMBL24914802 0.94 CLPP (0.61) CLPPENPP2MAPTDDB1CRBN
SCHEMBL24914512 0.94 CLPP (0.61) CLPPENPP2MAPTDDB1CRBN
SCHEMBL30130056 0.92 CLPP (0.54) CLPPENPP2TP53MAPT
SCHEMBL24914821 0.92 CLPP (0.54) CLPPMAPTDDB1CRBNTHRB
SCHEMBL24914422 0.92 CLPP (0.54) CLPPENPP2TP53MAPT
SCHEMBL24914459 0.92 CLPP (0.61) CLPPENPP2TP53CYP3A4MAPT

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
WO-2023284807-A1 COMPOUND CONTAINING TETRAHYDRONAPHTHYRIDONE OR TETRAHYDROPYRIDOPYRIMIDINONE SKELETON, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF 中国药科大学 2023-01-19 — — WO disclosed
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