SCHEMBL19716807

SCHEMBL19716807

N#Cc1c(Cl)nc(Cl)c(C#N)c1-c1ccco1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 11/20 0.53
ADORA2A P29274 8/20 0.53
ALDH1A1 P00352 7/20 0.53
KDM4E B2RXH2 5/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
ADORA3 P0DMS8 4/20 0.53
LMNA P02545 1/20 0.53
HSD17B10 Q99714 7/20 0.51
HPGD P15428 5/20 0.51
MAPT P10636 3/20 0.51
ALOX15 P16050 2/20 0.51
GAA P10253 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ADORA2B P29275 3/20 0.51
POLB P06746 1/20 0.51
CASP1 P29466 1/20 0.50
BLM P54132 1/20 0.50
USP2 O75604 1/20 0.50
HTT P42858 1/20 0.50

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
SCHEMBL19734593 0.89 ALDH1A1 (0.52) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL21116577 0.79 ALDH1A1 (0.51) ADORA1ADORA2AALDH1A1KDM4EMEN1
Ammonia Solution, Strong SCHEMBL19717396 0.78 ADORA1 (0.50) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL23162717 0.76 ADORA2A (0.53) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL6440893 0.76 ADORA2A (0.68) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL29623216 0.76 ADORA2A (0.53) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL6258393 0.76 ADORA1 (0.61) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL17498433 0.73 ALDH1A1 (0.58) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL6441030 0.73 KDM4E (0.75) ADORA1ADORA2AALDH1A1KDM4EMEN1
SCHEMBL1176202 0.73 KMT2A (0.58) ADORA1ADORA2AALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109563043-B Substituted pyridines as inhibitors of DNMT1 葛兰素史密斯克莱知识产权发展有限公司 2022-05-31 CN disclosed
US-10975056-B2 Substituted pyridines as inhibitors of DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-04-13 US disclosed
US-10975056-B2 Substituted pyridines as inhibitors of DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-04-13 US disclosed
US-20190194166-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-06-27 US disclosed
US-20190194166-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-06-27 US disclosed
EP-3468953-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-04-17 EP disclosed
WO-2017216726-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-12-21 WO disclosed
WO-2017216727-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-12-21 WO disclosed
WO-2017216727-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-12-21 WO disclosed
WO-2017216726-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-12-21 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 (2 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-10975056-B2 Substituted pyridines as inhibitors of DNMT1 DNMT1, DNMT3A, DNMT3B ADORA1 235/4885ADORA2A 395/4885ALDH1A1 496/4885
US-20190194166-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 DNMT1, DNMT3A, DNMT3B ADORA1 235/4885ADORA2A 395/4885ALDH1A1 496/4885

“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.