SCHEMBL6717715

SCHEMBL6717715

CC(C(=O)NCCN(C=O)OC(C)(C)C)c1n[nH]c(=O)c2c1CCCC2

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 20/20 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
SCHEMBL1251535 0.80 PARP1 (0.45) PARP1
SCHEMBL1252034 0.78 PARP1 (0.44) PARP1
Hydrochloric Acid SCHEMBL1252307 0.76 PARP1 (0.41) PARP1
Hydrochloric Acid SCHEMBL1252428 0.73 PARP1 (0.40) PARP1
SCHEMBL1249893 0.72 PARP1 (0.50) PARP1
SCHEMBL1252047 0.71 PARP1 (0.39) PARP1
SCHEMBL1252284 0.69 TSHR (0.56) PARP1
SCHEMBL1251951 0.67 POLB (0.51) PARP1
SCHEMBL19902540 0.63 PARP1 (0.51) PARP1
SCHEMBL1252318 0.62 PARP1 (0.47) 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
EP-1477175-A1 FUSED PYRIDAZINE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-17 — — EP disclosed
Send feedback