SCHEMBL7017660

SCHEMBL7017660

O=c1[nH]c(CCCC2CC(c3ccccc3)=CCN2)nc2c(Cl)cccc12

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 19/20 0.60
PARP2 Q9UGN5 6/20 0.52
KCNH2 Q12809 3/20 0.51
PARP14 Q460N5 1/20 0.43

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
Hydrochloric Acid SCHEMBL7019654 0.92 PARP1 (0.51) PARP1PARP2KCNH2PARP14
SCHEMBL7023192 0.89 PARP1 (0.49) PARP1PARP2KCNH2
SCHEMBL7021947 0.89 PARP1 (0.63) PARP1PARP2KCNH2PARP14
Hydrochloric Acid SCHEMBL7015519 0.89 PARP1 (0.49) PARP1PARP2KCNH2PARP14
SCHEMBL7017894 0.89 PARP1 (0.48) PARP1PARP2KCNH2
SCHEMBL7017391 0.88 PARP1 (0.47) PARP1PARP2KCNH2
Hydrochloric Acid SCHEMBL7019725 0.88 PARP1 (0.47) PARP1PARP2KCNH2PARP14
SCHEMBL7020655 0.85 PARP1 (0.45) PARP1PARP2KCNH2
Hydrochloric Acid SCHEMBL7018458 0.85 PARP1 (0.55) PARP1PARP2
SCHEMBL467535 0.85 PARP1 (0.60) PARP1PARP2

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
EP-1355888-A1 QUINAZOLINONE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-10-29 EP disclosed
WO-2002048117-A1 QUINAZOLINONE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-06-20 WO disclosed