SCHEMBL7750322

SCHEMBL7750322

N=C(N)N/N=C/c1cc(Cl)cc(Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.41
KDM4E B2RXH2 2/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.36
MAOB P27338 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
SCHEMBL7750327 1.00 PLK1 (0.41) PLK1KDM4EPOLBALDH1A1MEN1
Acetic Acid SCHEMBL917018 0.91 PLK1 (0.41) PLK1KDM4EPOLBALDH1A1MEN1
Acetic Acid SCHEMBL917020 0.91 PLK1 (0.41) PLK1KDM4EPOLBALDH1A1MEN1
SCHEMBL19449722 0.85 PLK1 (0.43) PLK1KDM4EPOLBALDH1A1MEN1
SCHEMBL18131646 0.84 POLB (0.40) KDM4EPOLBMEN1LMNAMAPT
SCHEMBL18130862 0.84 POLB (0.40) KDM4EPOLBMEN1LMNAMAPT
Hydrochloric Acid SCHEMBL17560860 0.83 PLK1 (0.42) PLK1KDM4EPOLBALDH1A1MEN1
SCHEMBL7748673 0.83 GRIN2D (0.55) KDM4EPOLBALDH1A1LMNAMAPT
SCHEMBL7748676 0.83 GRIN2D (0.55) KDM4EPOLBALDH1A1LMNAMAPT
Hydrochloric Acid SCHEMBL5703045 0.82 GRIN2D (0.56) KDM4EPOLBALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180111896-A1 INHIBITORS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2018-04-26 US claimed
EP-3280405-A1 INHIBITORS AND THEIR USES Medical Research Council (GB) 2018-02-14 EP claimed
WO-2016162689-A1 INHIBITORS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2016-10-13 WO claimed
WO-2001025192-A1 GUANIDINE DERIVATIVES AND THEIR USE IN THE PRODUCTION OF A MEDICAMENT FOR BLOCKING XANTHINE OXIDASE/DEHYDROGENASE MELACURE THERAPEUTICS AB (SE) 2001-04-12 WO claimed
US-11337941-B2 Inhibitors and their uses UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2022-05-24 US disclosed
US-11337941-B2 Inhibitors and their uses UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2022-05-24 US disclosed
US-11331286-B2 Inhibitors and their uses UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2022-05-17 US disclosed
US-11331286-B2 Inhibitors and their uses UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2022-05-17 US disclosed
US-11154519-B2 Inhibitors and their uses UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2021-10-26 US disclosed
US-11154519-B2 Inhibitors and their uses UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2021-10-26 US disclosed
EP-3280405-B1 INHIBITORS AND THEIR USES RES & INNOVATION UK (GB) 2021-07-07 EP disclosed
EP-3280405-B1 INHIBITORS AND THEIR USES RES & INNOVATION UK (GB) 2021-07-07 EP disclosed
US-20190330157-A1 THERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA 2019-10-31 US disclosed
US-20180111896-A1 INHIBITORS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2018-04-26 US disclosed
US-20180111896-A1 INHIBITORS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2018-04-26 US disclosed
US-20180111896-A1 INHIBITORS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2018-04-26 US disclosed
EP-3280405-A1 INHIBITORS AND THEIR USES Medical Research Council (GB) 2018-02-14 EP disclosed
WO-2016162689-A1 INHIBITORS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2016-10-13 WO disclosed
WO-2016162689-A1 INHIBITORS AND THEIR USES MEDICAL RESEARCH COUNCIL (GB) 2016-10-13 WO disclosed
WO-2001025192-A1 GUANIDINE DERIVATIVES AND THEIR USE IN THE PRODUCTION OF A MEDICAMENT FOR BLOCKING XANTHINE OXIDASE/DEHYDROGENASE MELACURE THERAPEUTICS AB (SE) 2001-04-12 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 (5 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-20180111896-A1 INHIBITORS AND THEIR USES PPP1R1B, PPP5C, PPP1R15A PLK1 1652/4885KDM4E 1965/4885POLB 3558/4885
US-20190330157-A1 THERAPEUTIC COMPOUNDS OPRL1, INA, OGFR PLK1 4577/4885KDM4E 2078/4885POLB 4376/4885
US-11154519-B2 Inhibitors and their uses PPP1R1B, PPP5C, PPP1R15A PLK1 1652/4885KDM4E 1965/4885POLB 3558/4885
US-11331286-B2 Inhibitors and their uses PPP1R1B, PPP5C, PPP1R15A PLK1 1652/4885KDM4E 1965/4885POLB 3558/4885
US-11337941-B2 Inhibitors and their uses PPP1R1B, PPP5C, PPP1R15A PLK1 1652/4885KDM4E 1965/4885POLB 3558/4885

“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.