SCHEMBL9694347

SCHEMBL9694347

CC(=O)OCc1ccncc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
KDM4C Q9H3R0 13/20 0.42
KDM6B O15054 6/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 2/20 0.42
KDM4A O75164 2/20 0.42
KDM4D Q6B0I6 2/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
SIRT3 Q9NTG7 1/20 0.38
ALKBH2 Q6NS38 1/20 0.36
ALKBH3 Q96Q83 1/20 0.36
FTO Q9C0B1 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36

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
SCHEMBL4608339 0.83 KDM4C (0.45) ALDH1A1KDM4CKDM6BMEN1KMT2A
SCHEMBL3886141 0.81 KDM4C (0.44) ALDH1A1KDM4CKDM6BMEN1KMT2A
SCHEMBL10679852 0.80 GPR119 (0.42) ALDH1A1MEN1KMT2ATDP1KDM4E
Acetic Acid SCHEMBL16666943 0.80 KDM4C (0.49) ALDH1A1KDM4CKDM6BMEN1KMT2A
SCHEMBL30465694 0.79 KDM4C (0.51) ALDH1A1KDM4CKDM6BMEN1KMT2A
SCHEMBL123203 0.79 KDM4C (0.51) ALDH1A1KDM4CKDM6BMEN1KMT2A
SCHEMBL2370442 0.78 KDM4C (0.46) ALDH1A1KDM4CKDM6BMEN1KMT2A
SCHEMBL38654957 0.76 ALDH1A1 (0.58) ALDH1A1TDP1KDM4EMAPTL3MBTL1
SCHEMBL2652361 0.76 ALDH1A1 (0.58) ALDH1A1TDP1KDM4EMAPTL3MBTL1
SCHEMBL3880004 0.75 KDM4C (0.50) ALDH1A1KDM4CKDM6BMEN1KMT2A

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