SCHEMBL7698386

SCHEMBL7698386

NC(=O)c1ccc(Oc2ccccc2)cc1C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 4/20 0.61
▸ SIRT2 Q8IXJ6 1/20 0.59
▸ SIRT1 Q96EB6 1/20 0.59
▸ CTNNB1 P35222 1/20 0.58
▸ 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
▸ POLB P06746 1/20 0.54
▸ AKR1C3 P42330 1/20 0.50
▸ MAPK8 P45983 1/20 0.49
▸ MAPK10 P53779 1/20 0.49
▸ 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
▸ PLA2G10 O15496 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46

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
Diphenylether SCHEMBL23068684 0.86 CTNNB1 (0.74) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL27491890 0.86 PARP10 (0.58) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL2661681 0.86 PARP10 (0.58) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL15317994 0.85 POLB (0.58) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL11780068 0.85 POLB (0.58) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL27991134 0.84 PARP10 (0.56) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL27486214 0.84 PARP10 (0.61) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL920637 0.84 PARP10 (0.56) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL28039268 0.84 PARP10 (0.56) PARP10SIRT2SIRT1CTNNB1PARP15
SCHEMBL28260959 0.84 PARP10 (0.56) PARP10SIRT2SIRT1CTNNB1PARP15

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-1216285-A1 FLUORESCENT MALEIMIDES AND USES THEREOF Ciba SC Holding AG (CH) 2002-06-26 — — EP disclosed
WO-2001019939-A1 FLUORESCENT MALEIMIDES AND USES THEREOF CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-03-22 — — WO disclosed
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