SCHEMBL2200157

SCHEMBL2200157

CCOC(=C(C#N)C#N)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 6/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 2/20 0.41
POLB P06746 1/20 0.39
LMNA P02545 2/20 0.38
GAA P10253 3/20 0.37
RAB9A P51151 2/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.36
DHODH Q02127 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
TP53 P04637 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
SCHEMBL18173604 0.87 LTA4H (0.46) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL27879907 0.80 KMT2A (0.48) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL7792871 0.80 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL3938851 0.79 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL1608024 0.76 KMT2A (0.46) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL9310847 0.76 MEN1 (0.46) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL11807023 0.76 TSHR (0.47) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL7067348 0.76 CYP19A1 (0.41) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL7067350 0.76 CYP19A1 (0.41) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL6396731 0.76 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043443-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY UNIV CASE WESTERN RESERVE (US) 2024-02-08 US disclosed
US-20210032265-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-02-04 US disclosed
US-20200140453-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-05-07 US disclosed
US-10301320-B2 Compositions and methods of modulating 15-PGDH activity UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2019-05-28 US disclosed
EP-3295940-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY Case Western Reserve University (US) 2018-03-21 EP disclosed
US-9790233-B2 Compositions and methods of modulating 15-PGDH activity CASE WESTERN RESERVE UNIVERSITY (US) 2017-10-17 US disclosed
EP-2838533-B1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY UNIV CASE WESTERN RESERVE (US) 2017-10-04 EP disclosed
US-20170165241-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-06-15 US disclosed
US-20150072998-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2015-03-12 US disclosed
EP-2838533-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY Case Western Reserve University (US) 2015-02-25 EP disclosed
US-20070155716-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-07-05 US disclosed
US-20070155716-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-07-05 US disclosed
EP-1799218-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES Tibotec Pharmaceuticals Ltd. (IE) 2007-06-27 EP disclosed
US-7223766-B2 Bi-cyclic pyrimidine inhibitors of TGFβ SCIOS, INC. (US) 2007-05-29 US disclosed
US-7223766-B2 Bi-cyclic pyrimidine inhibitors of TGFβ SCIOS, INC. (US) 2007-05-29 US disclosed
US-7223766-B2 Bi-cyclic pyrimidine inhibitors of TGFβ SCIOS, INC. (US) 2007-05-29 US disclosed
WO-2006035061-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES TIBOTEC PHARMACEUTICALS LTD. (IE) 2006-04-06 WO disclosed
EP-1608631-A2 BI-CYCLIC PYRIMIDINE INHIBITORS OF TGF BETA SCIOS INC. (US) 2005-12-28 EP disclosed
US-20050004143-A1 Bi-cyclic pyrimidine inhibitors of TGFbeta SCIOS, INC. 2005-01-06 US disclosed
WO-2004087056-A2 BI-CYCLIC PYRIMIDINE INHIBITORS OF TGFβ SCIOS INC. (US) 2004-10-14 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 (8 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-20170165241-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885ALDH1A1 415/4885MAPT 4311/4885
US-20070155716-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES UMPS, NUDT1, PNP SMN1; SMN2 4514/4885ALDH1A1 1844/4885MAPT 3915/4885
US-20200140453-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885ALDH1A1 415/4885MAPT 4311/4885
US-20050004143-A1 Bi-cyclic pyrimidine inhibitors of TGFbeta TYMP, TYMS, TGFBR1 SMN1; SMN2 2652/4885ALDH1A1 2042/4885MAPT 2053/4885
US-20240043443-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885ALDH1A1 415/4885MAPT 4311/4885
US-20150072998-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885ALDH1A1 415/4885MAPT 4311/4885
US-20210032265-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885ALDH1A1 415/4885MAPT 4311/4885
US-10301320-B2 Compositions and methods of modulating 15-PGDH activity PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885ALDH1A1 415/4885MAPT 4311/4885

“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.