SCHEMBL4664566

SCHEMBL4664566

CCc1cc(C#N)ccc1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.49
PTGDR2 Q9Y5Y4 1/20 0.49
ADRA2C P18825 1/20 0.45
CYP19A1 P11511 3/20 0.45
KCNA5 P22460 2/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
GALR3 O60755 1/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2A6 P11509 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
PGR P06401 1/20 0.40
IDO1 P14902 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRG2 P18507 1/20 0.40

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
SCHEMBL30477373 0.87 ADRA2C (0.47) EGLN2PTGDR2ADRA2CCYP19A1KCNA5
SCHEMBL15856515 0.86 CYP19A1 (0.55) EGLN2PTGDR2ADRA2CCYP19A1KCNA5
SCHEMBL2154388 0.85 EGLN2 (0.52) EGLN2ALDH1A1MEN1KMT2ACYP2A6
SCHEMBL14743162 0.84 DPP4 (0.37) EGLN2PTGDR2ALDH1A1KDM4EHPGD
SCHEMBL27751348 0.84 PTGDR2 (0.50) PTGDR2ADRA2CCYP19A1KCNA5ALDH1A1
SCHEMBL28273598 0.84 ADRA2C (0.44) EGLN2PTGDR2ADRA2CCYP19A1KCNA5
SCHEMBL4455682 0.83 TSHR (0.48) PTGDR2ADRA2CCYP19A1KCNA5ALDH1A1
SCHEMBL5697352 0.82 TSHR (0.50) PTGDR2ADRA2CCYP19A1ALDH1A1KDM4E
SCHEMBL5307030 0.82 TSHR (0.50) PTGDR2ADRA2CCYP19A1ALDH1A1KDM4E
SCHEMBL31364597 0.82 PTGDR2 (0.40) EGLN2PTGDR2ADRA2CCYP19A1KCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116367571-A Electroluminescent device, method of manufacturing the same, display apparatus including the same, and layered structure 三星电子株式会社 2023-06-30 CN disclosed
CN-113671068-B Method for analyzing environmental pollutant targeted exposure group in blood plasma and application thereof 暨南大学 2023-01-24 CN disclosed
EP-1638551-B1 IMMUNOSUPPRESSANT COMPOUNDS AND COMPOSITIONS IRM LLC (BM) 2011-12-21 EP disclosed
CN-1787817-B Immunosuppressant compounds and compositions IRM LLC 2011-09-07 CN disclosed
EP-1638551-A4 IMMUNOSUPPRESSANT COMPOUNDS AND COMPOSITIONS IRM LLC (BM) 2008-12-31 EP disclosed
CN-1787817-A Immunosuppressant compounds and compositions IRM LLC (BM) 2006-06-14 CN disclosed
US-7060697-B2 Immunosuppressant compounds and compositions IRM LLC (BM) 2006-06-13 US disclosed
EP-1638551-A2 IMMUNOSUPPRESSANT COMPOUNDS AND COMPOSITIONS IRM LLC (BM) 2006-03-29 EP disclosed
US-20050014724-A1 Immunosuppressant compounds and compositions IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2005-01-20 US disclosed
WO-2004103309-A2 IMMUNOSUPPRESSANT COMPOUNDS AND COMPOSITIONS IRM LLC (BM) 2004-12-02 WO disclosed
EP-0641372-B1 LIQUID CRYSTALLINE LIGHT MODULATING DEVICE & MATERIAL UNIV KENT STATE OHIO (US) 1999-04-21 EP disclosed
EP-0582656-B1 CRYSTALLINE LIGHT MODULATING DEVICE AND MATERIAL UNIV KENT STATE OHIO (US) 1999-04-07 EP disclosed
US-5695682-A Liquid crystalline light modulating device and material KENT STATE UNIVERSITY (US) 1997-12-09 US disclosed
US-5691795-A Polymer stabilized liquid crystalline light modulating device and material KENT STATE UNIVERSITY (US) 1997-11-25 US disclosed
US-5437811-A Liquid crystalline light modulating device and material KENT STATE UNIVERSITY (US) 1995-08-01 US disclosed
EP-0641372-A1 LIQUID CRYSTALLINE LIGHT MODULATING DEVICE & MATERIAL KENT STATE UNIVERSITY (US) 1995-03-08 EP disclosed
EP-0582656-A4 1994-04-13 EP disclosed
EP-0582656-A1 CRYSTALLINE LIGHT MODULATING DEVICE AND MATERIAL KENT STATE UNIVERSITY (US) 1994-02-16 EP disclosed
WO-1993023496-A1 LIQUID CRYSTALLINE LIGHT MODULATING DEVICE & MATERIAL KENT STATE UNIVERSITY (US) 1993-11-25 WO disclosed
WO-1992019695-A2 CRYSTALLINE LIGHT MODULATING DEVICE AND MATERIAL KENT STATE UNIVERSITY (US) 1992-11-12 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 (1 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-20050014724-A1 Immunosuppressant compounds and compositions ICOS, EDNRA, NFATC1 EGLN2 2775/4885PTGDR2 324/4885ADRA2C 2017/4885

“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.