SCHEMBL30546402

SCHEMBL30546402

Cc1cc(Cc2n[nH]c(=O)c3ccc(OC4CCC4)cc23)cc(C(=O)O)c1F

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 18/20 0.46
▸ PRMT5 O14744 2/20 0.44
▸ WDR77 Q9BQA1 2/20 0.44
▸ PRAP1 Q96NZ9 1/20 0.44

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
SCHEMBL26126855 1.00 PARP1 (0.46) PARP1PRMT5WDR77PRAP1
SCHEMBL30546182 0.87 PARP1 (0.58) PARP1PRAP1
SCHEMBL26122053 0.87 PARP1 (0.58) PARP1PRAP1
SCHEMBL26122073 0.86 PARP1 (0.49) PARP1PRMT5WDR77PRAP1
SCHEMBL26123985 0.83 PARP1 (0.45) PARP1PRMT5WDR77PRAP1
SCHEMBL30546280 0.81 PARP1 (0.57) PARP1PRAP1
SCHEMBL26123532 0.81 PARP1 (0.57) PARP1PRAP1
SCHEMBL26120440 0.81 PARP1 (0.49) PARP1PRMT5WDR77PRAP1
SCHEMBL30546371 0.81 PARP1 (0.49) PARP1PRMT5WDR77PRAP1
SCHEMBL30546251 0.80 PRMT5 (0.43) PARP1PRMT5WDR77PRAP1

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-2023192989-A2 PHTHALAZINONE COMPOUNDS AS PARP7 INHIBITORS AZKARRA THERAPEUTICS, INC. (US) 2023-10-05 — — WO disclosed
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