SCHEMBL24914821

SCHEMBL24914821

Cc1ccc(Cn2c(=O)c3c(c4cccnc42)CCN(Cc2cccc(Br)c2)C3)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 10/20 0.54
▸ DRD2 P14416 2/20 0.43
▸ DRD4 P21917 2/20 0.43
▸ DRD3 P35462 2/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ MAPT P10636 3/20 0.42
▸ THRB P10828 1/20 0.42
▸ DDB1 Q16531 1/20 0.41
▸ CRBN Q96SW2 1/20 0.41
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL24914820 0.94 CLPP (0.56) CLPPMAPTTHRBDDB1CRBN
SCHEMBL30130064 0.94 CLPP (0.56) CLPPMAPTTHRBDDB1CRBN
SCHEMBL24914802 0.93 CLPP (0.61) CLPPMAPTDDB1CRBN
SCHEMBL30130092 0.93 CLPP (0.61) CLPPMAPTDDB1CRBN
SCHEMBL24914512 0.93 CLPP (0.61) CLPPMAPTDDB1CRBN
SCHEMBL30130060 0.92 CLPP (0.54) CLPPMAPTTHRBDDB1CRBN
SCHEMBL24914819 0.92 CLPP (0.54) CLPPMAPTTHRBDDB1CRBN
SCHEMBL30130056 0.91 CLPP (0.54) CLPPMAPT
SCHEMBL24914422 0.91 CLPP (0.54) CLPPMAPT
SCHEMBL24914833 0.90 CLPP (0.54) CLPPDRD2DRD4DRD3RXFP1

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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