SCHEMBL24914802

SCHEMBL24914802

O=c1c2c(c3cccnc3n1Cc1cccc(Br)c1)CCN(Cc1ccccc1)C2

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 12/20 0.61
▸ DDB1 Q16531 1/20 0.47
▸ CRBN Q96SW2 1/20 0.47
▸ ENPP2 Q13822 5/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.43
▸ MAPT P10636 1/20 0.42

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
SCHEMBL30130092 1.00 CLPP (0.61) CLPPDDB1CRBNENPP2HDAC6
SCHEMBL24914512 1.00 CLPP (0.61) CLPPDDB1CRBNENPP2HDAC6
SCHEMBL30130064 0.95 CLPP (0.56) CLPPDDB1CRBNENPP2MAPT
SCHEMBL24914820 0.95 CLPP (0.56) CLPPDDB1CRBNENPP2MAPT
SCHEMBL30130060 0.94 CLPP (0.54) CLPPDDB1CRBNENPP2MAPT
SCHEMBL24914819 0.94 CLPP (0.54) CLPPDDB1CRBNENPP2MAPT
SCHEMBL30130056 0.93 CLPP (0.54) CLPPENPP2MAPT
SCHEMBL24914422 0.93 CLPP (0.54) CLPPENPP2MAPT
SCHEMBL24914821 0.93 CLPP (0.54) CLPPDDB1CRBNMAPT
SCHEMBL24915151 0.91 CLPP (0.60) CLPPDDB1CRBNENPP2HDAC6

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
Send feedback