SCHEMBL15775476

SCHEMBL15775476

Cc1cccc2c(=O)[nH]c(-c3ccccc3)nc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TNKS O95271 17/20 1.00
TNKS2 Q9H2K2 17/20 1.00
PARP1 P09874 12/20 1.00
PARP2 Q9UGN5 5/20 0.76

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
SCHEMBL15775325 0.89 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL15775474 0.87 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL15775251 0.87 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL15775692 0.87 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL7569320 0.87 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL15775949 0.87 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL17829611 0.84 TNKS (0.72) TNKSTNKS2PARP1PARP2
SCHEMBL17833265 0.84 TNKS (0.72) TNKSTNKS2PARP1PARP2
SCHEMBL7566607 0.84 TNKS (1.00) TNKSTNKS2PARP1PARP2
SCHEMBL17829691 0.84 TNKS (0.76) TNKSTNKS2PARP1PARP2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103880761-B The method of one pot process 4 (3H)-Quinazol derivative is eliminated by cyclization TIANJIN UNIVERSITY (CN) 2015-07-29 CN disclosed
CN-103880761-A Method for synthesizing 4(3H)-quinazolinone derivative by using cyclization elimination one-pot method UNIV TIANJIN 2014-06-25 CN disclosed
WO-2014087165-A1 TANKYRASE INHIBITORS UNIVERSITY OF BATH (GB) 2014-06-12 WO disclosed