SCHEMBL10997559

SCHEMBL10997559

Cn1c(O)c(N=Nc2ccccc2)n(C)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.48
▸ ALDH1A1 P00352 5/20 0.48
▸ LMNA P02545 5/20 0.48
▸ HTT P42858 3/20 0.48
▸ KMT2A Q03164 7/20 0.47
▸ MEN1 O00255 6/20 0.47
▸ HSD17B10 Q99714 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.44
▸ TDP1 Q9NUW8 3/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ NPC1 O15118 2/20 0.42
▸ SMN1; SMN2 Q16637 5/20 0.41
▸ GAA P10253 3/20 0.41
▸ XDH P47989 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ RAB9A P51151 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ TRPA1 O75762 1/20 0.39
▸ ALOX15 P16050 1/20 0.39

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
SCHEMBL10996345 0.78 ALPG (0.42) MAPTALDH1A1LMNAHTTKMT2A
SCHEMBL10997907 0.71 KMT2A (0.46) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL11000208 0.71 ALPL (0.55) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL10997208 0.69 HTT (0.36) MAPTALDH1A1LMNAHTTHSD17B10
Azobenzene SCHEMBL182578 0.67 ALDH1A1 (0.92) MAPTALDH1A1HTTKMT2AMEN1
Azobenzene SCHEMBL182577 0.67 ALDH1A1 (0.92) MAPTALDH1A1HTTKMT2AMEN1
Azobenzene SCHEMBL29154401 0.66 ALDH1A1 (0.67) MAPTALDH1A1LMNAHTTKMT2A
Azobenzene SCHEMBL9435350 0.65 ALDH1A1 (0.75) MAPTALDH1A1LMNAHTTKMT2A
Azobenzene SCHEMBL475771 0.65 ALDH1A1 (0.75) MAPTALDH1A1LMNAHTTKMT2A
Azobenzene SCHEMBL11328908 0.65 ALDH1A1 (0.86) MAPTALDH1A1LMNAHTTKMT2A

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
EP-0158921-A2 5-Imino-imidazolidinedione derivatives and process for the preparation of N,N'-disubstituted 5-imino-imidazolidinediones BAYER AG (DE) 1985-10-23 — — EP disclosed
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