SCHEMBL9693906

SCHEMBL9693906

COC(=O)c1cccnc1C(OC(C)=O)OC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
KDM4E B2RXH2 5/20 0.47
MAP2K1 Q02750 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
PKM P14618 1/20 0.44
POLB P06746 2/20 0.42
ATM Q13315 1/20 0.42
CNR2 P34972 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 5/20 0.40
CFTR P13569 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
PSMD14 O00487 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 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
SCHEMBL9963329 0.82 TDP1 (0.54) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL24968313 0.80 MAP2K1 (0.53) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL16344365 0.80 TDP1 (0.55) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL27497542 0.78 TDP1 (0.50) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL18551398 0.75 TDP1 (0.47) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL2036100 0.73 TDP1 (0.49) TDP1KDM4EL3MBTL1PKMPOLB
SCHEMBL812065 0.73 KDM4E (0.59) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL29906660 0.72 TDP1 (0.45) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL2800466 0.72 L3MBTL1 (0.54) TDP1KDM4EMAP2K1L3MBTL1PKM
SCHEMBL107721 0.72 KDM4E (0.57) TDP1KDM4EMAP2K1L3MBTL1PKM

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-0277661-B1 IMIDAZOPYRROLOPYRIDINES AND CONDENSED DERIVATIVES THEREOF USEFUL IN THE PREPARATION OF HERBICIDAL COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1992-09-16 EP disclosed
EP-0133309-B1 HERBICIDES AND METHOD FOR THE PREPARATION THEREOF AMERICAN CYANAMID COMPANY (US) 1989-11-23 EP disclosed
EP-0133310-B1 IMIDAZOLIDINONES, AND IMIDAZOLIDINETHIONES, PROCESS FOR THE PREPARATION THEREOF, AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS AMERICAN CYANAMID COMPANY (US) 1988-09-14 EP disclosed
EP-0277661-A1 Imidazopyrrolopyridines and condensed derivatives thereof useful in the preparation of herbicidal compounds AMERICAN CYANAMID COMPANY (US) 1988-08-10 EP disclosed
US-4701208-A Dihydroimidazopyrrolopyridine, quinoline, thieno- and furo[2,3-b]pyridine, dihydrothieno- and furo[2,3-b]-pyridine, thieno- and furo[3,2-b]pyridine and dihydrothieno- and furo[3,2-b]pyridine herbicides and method for preparation thereof AMERICAN CYANAMID COMPANY (US) 1987-10-20 US disclosed
US-4608079-A Imidazolidinones, and imidazolidinethiones, process and intermediates for the preparation thereof, and use of said compounds as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1986-08-26 US disclosed
EP-0133310-A1 Imidazolidinones, and imidazolidinethiones, process for the preparation thereof, and use of said compounds as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1985-02-20 EP disclosed
EP-0133309-A1 Herbicides and method for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1985-02-20 EP disclosed