SCHEMBL4608767

SCHEMBL4608767

CCN(CC)C(=O)C(C#N)=C(O)c1cc(OC)c(OC)c([N+](=O)[O-])c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 6/20 0.68
COMT P21964 5/20 0.68
TPMT P51580 1/20 0.43
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
ABCC3 O15438 1/20 0.41
ABCC4 O15439 1/20 0.41
ABCB11 O95342 1/20 0.41
LMNA P02545 1/20 0.41
CYP2C9 P11712 1/20 0.41
GPR35 Q9HC97 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ABCB1 P08183 2/20 0.38
ABCC1 P33527 2/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38

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
SCHEMBL4609816 1.00 FTO (0.68) FTOCOMTTPMTKMT2AMEN1
SCHEMBL4608763 1.00 FTO (0.68) FTOCOMTTPMTKMT2AMEN1
SCHEMBL32669761 0.90 FTO (0.77) FTOCOMTKMT2AMEN1ABCC3
SCHEMBL29493655 0.88 COMT (0.72) FTOCOMTTPMTKMT2AMEN1
SCHEMBL29493677 0.84 COMT (0.51) FTOCOMTTPMTKMT2AMEN1
SCHEMBL8471655 0.83 TPMT (0.47) FTOCOMTTPMTKMT2AMEN1
SCHEMBL20100877 0.83 FTO (0.53) FTOCOMTTPMTKMT2AMEN1
SCHEMBL30740891 0.82 FTO (0.47) FTOCOMTTPMTKMT2AMEN1
SCHEMBL20100822 0.81 COMT (1.00) FTOCOMTKMT2AMEN1ABCC3
SCHEMBL29493648 0.81 COMT (1.00) FTOCOMTKMT2AMEN1ABCC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3885337-B1 FTO INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2025-01-15 EP disclosed
CN-107922316-B FTO inhibitors 北京生命科学研究所 2022-04-08 CN disclosed
EP-3885337-A1 FTO INHIBITORS National Institute Of Biological Sciences, Beijing (CN) 2021-09-29 EP disclosed
US-20210238127-A1 FTO Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-08-05 US disclosed
US-10988440-B2 FTO inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-04-27 US disclosed
EP-3303283-B1 FTO INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2021-04-21 EP disclosed
US-20200148628-A1 FTO Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2020-05-14 US disclosed
US-20180118665-A1 FTO Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2018-05-03 US disclosed
EP-3303283-A1 FTO INHIBITORS National Institute Of Biological Sciences, Beijing (CN) 2018-04-11 EP disclosed
WO-2016206573-A1 FTO INHIBITORS NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2016-12-29 WO disclosed
WO-2008119793-A1 PROCESS FOR THE PREPARATION OF ENTACAPONE AND INTERMEDIATES THEREOF Esteve Química, S.A. (ES) 2008-10-09 WO disclosed
EP-1978014-A1 Process for the preparation of entacapone and intermediates thereof ESTEVE QUIMICA, S.A. (ES) 2008-10-08 EP disclosed
EP-1978014-A1 Process for the preparation of entacapone and intermediates thereof ESTEVE QUIMICA, S.A. (ES) 2008-10-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180118665-A1 FTO Inhibitors FTO, ALKBH3, ALKBH1 FTO 1/4885COMT 9/4885TPMT 278/4885
US-20210238127-A1 FTO Inhibitors FTO, ALKBH3, ALKBH1 FTO 1/4885COMT 9/4885TPMT 278/4885
US-20200148628-A1 FTO Inhibitors FTO, ALKBH3, ALKBH1 FTO 1/4885COMT 9/4885TPMT 278/4885
US-10988440-B2 FTO inhibitors FTO, ALKBH3, ALKBH1 FTO 1/4885COMT 9/4885TPMT 278/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.