SCHEMBL17396331

SCHEMBL17396331

CCOC(=O)c1nc(-c2ccc(C#N)cc2)cs1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.56
KDM4E B2RXH2 8/20 0.51
ALDH1A1 P00352 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
MAPK1 P28482 1/20 0.48
HPGD P15428 3/20 0.46
MAPT P10636 8/20 0.46
TP53 P04637 2/20 0.45
THRB P10828 1/20 0.45
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HTT P42858 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
RECQL P46063 1/20 0.45
RAB9A P51151 2/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL12942054 0.85 ADORA2A (0.48) GAAKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL2705788 0.85 KDM4E (0.56) GAAKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL28928759 0.84 ESR1 (0.49) GAAKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL3612395 0.83 MAPT (0.57) KDM4EALDH1A1SMN1; SMN2MAPK1HPGD
SCHEMBL1173463 0.83 PRKCZ (0.54) GAAKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL10222539 0.83 ALDH1A1 (0.58) KDM4EALDH1A1SMN1; SMN2MAPK1HPGD
SCHEMBL5733736 0.82 CDC7 (0.53) ALDH1A1MAPK1HPGDMAPTMEN1
SCHEMBL694852 0.82 ALDH1A1 (0.56) GAAKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL12941873 0.82 KDM4E (0.42) GAAKDM4EALDH1A1SMN1; SMN2MAPK1
SCHEMBL18425631 0.82 RAB9A (0.57) GAAKDM4EALDH1A1SMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3511319-B1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2023-05-03 EP disclosed
EP-3511319-B1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2023-05-03 EP disclosed
EP-3164380-B1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2022-02-09 EP disclosed
CN-108530424-B Inhibitors of lysine-specific demethylase-1 赛尔基因昆蒂赛尔研究公司 2021-10-01 CN disclosed
EP-3511319-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 Celgene Quanticel Research, Inc. (US) 2019-07-17 EP disclosed
EP-3511319-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 Celgene Quanticel Research, Inc. (US) 2019-07-17 EP disclosed
US-20190002456-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2019-01-03 US disclosed
US-20190002456-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2019-01-03 US disclosed
US-10100046-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2018-10-16 US disclosed
US-20180127408-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2018-05-10 US disclosed
US-20180127408-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2018-05-10 US disclosed
US-9902719-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2018-02-27 US disclosed
US-9902719-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2018-02-27 US disclosed
US-20170129882-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2017-05-11 US disclosed
US-20170129882-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2017-05-11 US disclosed
EP-3164380-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 Celgene Quanticel Research, Inc. (US) 2017-05-10 EP disclosed
WO-2016003917-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 Quanticel Pharmaceuticals, Inc. (US) 2016-01-07 WO disclosed
WO-2016003917-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 Quanticel Pharmaceuticals, Inc. (US) 2016-01-07 WO 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-20170129882-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 KDM1B, KDM1A, KDM3A GAA 1295/4885KDM4E 16/4885ALDH1A1 235/4885
US-20180127408-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 KDM1B, KDM1A, KDM3A GAA 1295/4885KDM4E 16/4885ALDH1A1 235/4885
US-10100046-B2 Inhibitors of lysine specific demethylase-1 KDM1B, KDM1A, KDM3A GAA 1295/4885KDM4E 16/4885ALDH1A1 235/4885
US-20190002456-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 KDM1B, KDM1A, KDM3A GAA 1295/4885KDM4E 16/4885ALDH1A1 235/4885

“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.