SCHEMBL9250237

SCHEMBL9250237

CCCCOC(=O)COc1ccc(Cl)c2cccnc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.62
MAPT P10636 4/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
ALDH1A1 P00352 4/20 0.58
L3MBTL1 Q9Y468 4/20 0.58
TDP1 Q9NUW8 2/20 0.58
KDM4E B2RXH2 10/20 0.55
CYP3A4 P08684 1/20 0.55
ALOX12 P18054 1/20 0.55
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.51
NPSR1 Q6W5P4 2/20 0.47
HTT P42858 1/20 0.47
HSP90AA1 P07900 2/20 0.46
CCR6 P51684 1/20 0.46
KMT2A Q03164 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 2/20 0.46
KDM4A O75164 1/20 0.45
KDM4C Q9H3R0 1/20 0.45

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
SCHEMBL9245440 0.98 PKM (0.60) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9862569 0.97 PKM (0.61) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9248700 0.95 PKM (0.60) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9245319 0.95 PKM (0.60) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9245424 0.95 PKM (0.60) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9248708 0.95 PKM (0.60) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9245358 0.95 PKM (0.60) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9248458 0.94 PKM (0.55) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9830689 0.93 PKM (0.57) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9828551 0.88 PKM (0.54) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0407341-B1 Selective herbicidal agent CIBA GEIGY AG (CH) 1995-12-06 EP claimed
US-5059239-A Preemergence; postemergence; grains CIBA-GEIGY CORPORATION (US) 1991-10-22 US claimed
EP-0191736-B1 USE OF QUINOLINE DERIVATIVES FOR THE PROTECTION OF CROP PLANTS CIBA-GEIGY AG (CH) 1991-07-17 EP claimed
EP-0159287-B1 USE OF QUINOLINE DERIVATIVES TO PROTECT CULTIVATED PLANTS CIBA-GEIGY AG (CH) 1989-10-11 EP claimed
US-4851031-A Use of quinoline derivatives for protecting cultivated plants CIBA-GEIGY CORPORATION (US) 1989-07-25 US claimed
EP-0524394-A1 Safener for insecticide-herbicide compositions AMERICAN CYANAMID COMPANY (US) 1993-01-27 EP disclosed
US-4881966-A PLANT SAFENING AGENTS CIBA-GEIGY CORPORATION (US) 1989-11-21 US disclosed
US-4851031-A Use of quinoline derivatives for protecting cultivated plants CIBA-GEIGY CORPORATION (US) 1989-07-25 US disclosed