SCHEMBL16670962

SCHEMBL16670962

NC(=O)c1[c]c(=O)[nH]cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.39
▸ IKBKB O14920 4/20 0.35
▸ CHUK O15111 4/20 0.35
▸ PARP10 Q53GL7 3/20 0.34
▸ PARP15 Q460N3 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ PARP4 Q9UKK3 2/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PARP14 Q460N5 1/20 0.34
▸ PARP16 Q8N5Y8 1/20 0.34
▸ PARP11 Q9NR21 1/20 0.34
▸ PARP1 P09874 3/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ BLM P54132 1/20 0.33

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
SCHEMBL269378 0.69 — —
SCHEMBL7305438 0.67 PARP1 (0.48) PARP10PARP15ALDH1A1PARP4KMT2A
SCHEMBL1388043 0.67 — —
SCHEMBL4881611 0.64 — —
SCHEMBL6163681 0.64 MEN1 (0.44) ALDH1A1KMT2APARP1HSD17B10POLB
SCHEMBL162641 0.62 — —
SCHEMBL338568 0.61 CCNC (0.43) PDPK1IKBKBCHUKALDH1A1KMT2A
SCHEMBL28817336 0.61 CYP3A4 (0.41) PARP10PARP15ALDH1A1PARP4KMT2A
SCHEMBL15873490 0.60 PARP1 (0.45) PARP10PARP15PARP14PARP1HSD17B10
SCHEMBL16752418 0.60 PARP1 (0.45) PARP10PARP15PARP4PARP1HSD17B10

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-3060046-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS Dow AgroSciences LLC (US) 2016-08-31 — — EP disclosed
WO-2015061161-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC (US) 2015-04-30 — — WO disclosed
Send feedback