SCHEMBL19005236

SCHEMBL19005236

CC(C)(O)c1c(C(F)(F)F)nc2n1CCN(C(=O)c1cc(Cc3n[nH]c(=O)c4ccccc34)ccc1F)C2

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 20/20 0.71

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
SCHEMBL28377418 0.88 PARP1 (0.75) PARP1
SCHEMBL19005603 0.88 PARP1 (0.70) PARP1
SCHEMBL19005723 0.87 PARP1 (0.72) PARP1
SCHEMBL19005837 0.86 PARP1 (0.68) PARP1
SCHEMBL19005830 0.86 PARP1 (0.68) PARP1
SCHEMBL19005601 0.85 PARP1 (0.70) PARP1
SCHEMBL19005242 0.85 PARP1 (0.85) PARP1
SCHEMBL28378755 0.83 PARP1 (0.74) PARP1
SCHEMBL30888477 0.83 PARP1 (0.88) PARP1
SCHEMBL19005724 0.83 PARP1 (0.88) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107207504-B Phthalazinone derivatives, preparation method and use thereof 四川科伦博泰生物医药股份有限公司 2020-03-10 CN disclosed
WO-2017101796-A1 PHTHALAZINONE DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2017-06-22 WO disclosed