SCHEMBL22424333

SCHEMBL22424333

COc1ccc(CNc2nc3c(c(=O)[nH]2)CCN(C(=O)c2ccc(Cl)c(Cl)c2)C3)cc1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 11/20 0.54
▸ PRLHR P49683 3/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.43
▸ GRM5 P41594 1/20 0.43
▸ PDE9A O76083 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPK10 P53779 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
SCHEMBL22424550 0.94 CLPP (0.53) CLPPPRLHRHDAC6GRM5PDE9A
SCHEMBL22424585 0.93 CLPP (0.52) CLPPPRLHRHDAC6GRM5PDE9A
SCHEMBL22424217 0.93 CLPP (0.52) CLPPPRLHRHDAC6GRM5PDE9A
SCHEMBL22424384 0.91 CLPP (0.51) CLPPPRLHRHDAC6GRM5PDE9A
SCHEMBL22424574 0.91 CLPP (0.51) CLPPPRLHRHDAC6GRM5PDE9A
SCHEMBL22423998 0.89 CLPP (0.60) CLPPHPGD
SCHEMBL22424581 0.89 CLPP (0.52) CLPPPRLHRGRM5PDE9AHPGD
SCHEMBL22424586 0.87 CLPP (0.51) CLPPPRLHRGRM5PDE9AHPGD
SCHEMBL22424577 0.86 CLPP (0.50) CLPPPRLHRGRM5PDE9AHPGD
SCHEMBL22423946 0.86 CLPP (0.50) CLPPPRLHRGRM5PDE9AHPGD

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-2020182990-A1 FUSED RING PYRIMIDONE DERIVATIVES FOR USE IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES Janssen Sciences Ireland Unlimited Company (IE) 2020-09-17 — — WO disclosed
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