SCHEMBL19716484

SCHEMBL19716484

CC(=O)NCc1ccc(COS(C)(=O)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
HDAC1 Q13547 5/20 0.50
HDAC6 Q9UBN7 1/20 0.50
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
RAB9A P51151 1/20 0.49
HDAC3 O15379 4/20 0.47
HDAC2 Q92769 4/20 0.47
GAA P10253 1/20 0.46
MMP2 P08253 1/20 0.45
MMP8 P22894 1/20 0.45
HDAC8 Q9BY41 3/20 0.43
HDAC4 P56524 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ADAMTS4 O75173 1/20 0.43
MMP13 P45452 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
RORC P51449 1/20 0.41

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
SCHEMBL19716620 0.80 CA1 (0.50) KMT2AHDAC1MAPTGAATDP1
SCHEMBL12133623 0.80 KMT2A (0.76) KMT2AHDAC1HDAC6MAPTALDH1A1
SCHEMBL4952656 0.80 CA2 (0.58) KMT2AALDH1A1RAB9AKDM4EHTT
SCHEMBL19734631 0.79 KMT2A (0.59) KMT2AHDAC1HDAC6MAPTALDH1A1
SCHEMBL14651456 0.78 SETDB1 (0.44) KMT2AALDH1A1KDM4E
SCHEMBL19716984 0.77 ALDH1A1 (0.58) KMT2AALDH1A1
SCHEMBL12545535 0.77 ALDH1A1 (0.58) KMT2AHDAC1HDAC6MAPTALDH1A1
SCHEMBL22158837 0.77 KMT2A (0.53) KMT2AMAPTALDH1A1RAB9AHTT
SCHEMBL5445398 0.77 EPHX2 (0.59) KMT2AHDAC1HDAC6MAPTALDH1A1
SCHEMBL3612557 0.76 KMT2A (0.66) KMT2AHDAC1HDAC6MAPTALDH1A1

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 7 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-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
CN-109563043-A SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 葛兰素史密斯克莱知识产权发展有限公司 2019-04-02 CN 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 KMT2A 121/4885HDAC1 44/4885HDAC6 643/4885
US-20190194166-A1 SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 DNMT1, DNMT3A, DNMT3B KMT2A 121/4885HDAC1 44/4885HDAC6 643/4885

“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.