SCHEMBL22423997

SCHEMBL22423997

O=C(c1ccc(Cl)c(Cl)c1)N1CCc2c(nc(NCc3ccccc3)n(-c3ccccc3)c2=O)C1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PRLHR P49683 4/20 0.47
▸ CLPP Q16740 2/20 0.41
▸ MTHFD2 P13995 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ GRM1 Q13255 5/20 0.39
▸ HTT P42858 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ POLB P06746 1/20 0.38

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
SCHEMBL22424544 0.88 PRLHR (0.49) PRLHRCLPPMTHFD2LMNAMAPT
SCHEMBL22424690 0.87 PRLHR (0.49) PRLHRLMNAMAPTALDH1A1GRM1
SCHEMBL22424388 0.86 PRLHR (0.47) PRLHRLMNAMAPTALDH1A1
SCHEMBL22410896 0.84 PRLHR (0.49) PRLHRLMNAMAPTALDH1A1POLB
SCHEMBL22423999 0.84 PRLHR (0.50) PRLHRCLPPMTHFD2LMNAMAPT
SCHEMBL22424572 0.84 PRLHR (0.47) PRLHRLMNAMAPTALDH1A1GAA
SCHEMBL22424283 0.84 PRLHR (0.50) PRLHRCLPPLMNAMAPT
SCHEMBL22423960 0.84 PRLHR (0.48) PRLHRLMNAMAPTALDH1A1POLB
SCHEMBL22424014 0.83 PRLHR (0.51) PRLHRCLPPLMNAMAPTALDH1A1
SCHEMBL22424139 0.83 PRLHR (0.49) PRLHRLMNAMAPTALDH1A1POLB

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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