SCHEMBL11700754

SCHEMBL11700754

NC(=O)c1ccc(N)c(Oc2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 9/20 0.61
PARP15 Q460N3 3/20 0.54
PARP14 Q460N5 2/20 0.54
TNKS O95271 1/20 0.54
TNKS2 Q9H2K2 1/20 0.54
PARP2 Q9UGN5 1/20 0.54
CTNNB1 P35222 1/20 0.53
TTR P02766 2/20 0.50
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 1/20 0.48
PARP16 Q8N5Y8 1/20 0.48
PARP11 Q9NR21 1/20 0.48
PARP4 Q9UKK3 1/20 0.48
CHEK2 O96017 1/20 0.45
PARP1 P09874 2/20 0.45
F10 P00742 1/20 0.45
ICAM1 P05362 1/20 0.45
SELE P16581 1/20 0.45
BRD4 O60885 1/20 0.44
CYP3A4 P08684 2/20 0.44

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
SCHEMBL31343926 0.88 SRD5A2 (0.51) PARP10CTNNB1TTRALDH1A1CYP3A4
SCHEMBL1855981 0.88 SRD5A2 (0.51) PARP10CTNNB1TTRALDH1A1CYP3A4
SCHEMBL1477680 0.88 TTR (0.64) PARP10PARP15CTNNB1TTRALDH1A1
SCHEMBL11702647 0.87 PARP10 (0.61) PARP10PARP15PARP14TNKSTNKS2
SCHEMBL1852465 0.87 SRD5A2 (0.54) PARP10CTNNB1TTRALDH1A1KMT2A
SCHEMBL3645145 0.85 SRD5A2 (0.53) PARP10TTRALDH1A1KMT2ACYP2C19
SCHEMBL9655279 0.85 TTR (0.53) PARP10CTNNB1TTRALDH1A1KMT2A
SCHEMBL1854067 0.84 ATM (0.52) PARP10PARP15PARP14TNKSTNKS2
SCHEMBL28269929 0.84 HPSE (0.54) PARP10CTNNB1TTRALDH1A1F10
SCHEMBL1855090 0.83 HTT (0.53) PARP10CTNNB1TTRALDH1A1CYP3A4

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-4031073-A Monoazo pigments containing barbituric acid or thio- or imino-derivatives thereof CIBA-GEIGY CORPORATION (US) 1977-06-21 US disclosed