SCHEMBL14131264

SCHEMBL14131264

CCC(=O)NCCc1n[nH]c(=O)c2c1CCCC2

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 20/20 0.49

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
SCHEMBL14026587 0.87 PARP1 (0.52) PARP1
SCHEMBL1251335 0.87 PARP1 (0.49) PARP1
SCHEMBL1252227 0.86 PARP1 (0.49) PARP1
SCHEMBL14131265 0.86 PARP1 (0.52) PARP1
Hydrochloric Acid SCHEMBL1251417 0.85 PARP1 (0.52) PARP1
SCHEMBL1252020 0.84 PARP1 (0.47) PARP1
SCHEMBL14131585 0.84 PARP1 (0.50) PARP1
Hydrochloric Acid SCHEMBL4913748 0.83 PARP1 (0.49) PARP1
SCHEMBL1252606 0.82 PARP1 (0.50) PARP1
Hydrochloric Acid SCHEMBL1252654 0.81 PARP1 (0.45) PARP1

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
US-7402580-B2 Fused pyridazine derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-07-22 — — US disclosed
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