SCHEMBL9655607

SCHEMBL9655607

CCOC(=O)C(C)Oc1cc(N2C(=O)CC(=C(C)C)C2=O)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPOX P50336 2/20 0.44
ALDH1A1 P00352 7/20 0.38
KDM4E B2RXH2 7/20 0.38
MAPT P10636 5/20 0.38
HPGD P15428 4/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HTT P42858 3/20 0.35
MAPK1 P28482 2/20 0.35
TSHR P16473 4/20 0.35
NPSR1 Q6W5P4 3/20 0.34
HSD17B10 Q99714 3/20 0.34
LMNA P02545 1/20 0.34
ALOX15 P16050 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
GAA P10253 2/20 0.33
PKM P14618 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
SCHEMBL9655541 0.90 ALDH1A1 (0.42) PPOXALDH1A1KDM4EMAPTHPGD
SCHEMBL9654764 0.85 PPOX (0.52) PPOXALDH1A1KDM4EMAPTHPGD
SCHEMBL9655645 0.85 PTGDR (0.39) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL9656338 0.85 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL9653017 0.82 ALDH1A1 (0.40) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL9655383 0.82 GAA (0.52) PPOXALDH1A1KDM4EMAPTHPGD
SCHEMBL9654826 0.82 PPOX (0.64) PPOXALDH1A1KDM4EMAPTHPGD
SCHEMBL9653027 0.82 RXRA (0.38) ALDH1A1KDM4EMAPT
SCHEMBL9655570 0.80 ALDH1A1 (0.35) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL9656287 0.80 ALDH1A1 (0.37) ALDH1A1KDM4EMAPTMEN1KMT2A

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-0190755-B1 AN N-SUBSTITUTED-PHENYLTERACONIMIDE COMPOUND, HERBICIDAL COMPOSITION, AND METHOD FOR THE DESTRUCTION OF UNDESIRABLE WEEDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1992-06-17 EP disclosed
US-4964905-A N-substituted-phenylteraconimide compound, herbicidal composition, and method for the destruction of undesirable weeds ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1990-10-23 US disclosed