SCHEMBL827255

SCHEMBL827255

CN(C)C(=O)c1cccc2ncccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.51
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
PABPC1 P11940 3/20 0.46
EIF4H Q15056 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
P2RX7 Q99572 1/20 0.45
ACLY P53396 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
POLB P06746 2/20 0.42
NR4A1 P22736 1/20 0.42
ESR2 Q92731 1/20 0.42
GAA P10253 1/20 0.42
PKN1 Q16512 1/20 0.42
PKN2 Q16513 1/20 0.42
HDAC6 Q9UBN7 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
SCHEMBL8568156 0.88 PREP (0.47) NSD2MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL28500036 0.83 NSD2 (0.51) NSD2MEN1KMT2APABPC1EIF4H
SCHEMBL827107 0.81 MEN1 (0.58) NSD2MEN1KMT2APABPC1EIF4H
SCHEMBL27719184 0.80 NSD2 (0.58) NSD2MEN1KMT2APABPC1EIF4H
SCHEMBL29550511 0.79 NSD2 (0.60) NSD2MEN1KMT2APABPC1EIF4H
SCHEMBL335469 0.79 NSD2 (0.60) NSD2MEN1KMT2APABPC1EIF4H
Dimethylformamide SCHEMBL27628074 0.78 NSD2 (0.50) NSD2MEN1KMT2APABPC1EIF4H
Acetic Acid SCHEMBL27656229 0.78 NSD2 (0.56) NSD2MEN1KMT2APABPC1EIF4H
SCHEMBL1133969 0.77 NSD2 (0.55) NSD2MEN1KMT2APABPC1EIF4H
SCHEMBL2314272 0.77 NSD2 (0.55) NSD2MEN1KMT2APABPC1EIF4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112020500-A Aminopyridine derivatives as inhibitors of phosphatidylinositol phosphokinase 拉文纳制药公司 2020-12-01 CN disclosed
US-8507680-B2 Production process of a heteroaryl-type boron compounds with iridium catalyst MITSUBISHI RAYON CO., LTD. (JP) 2013-08-13 US disclosed
US-20120142924-A1 PRODUCTION PROCESS OF A HETEROARYL-TYPE BORON COMPOUNDS WITH IRIDIUM CATALYST MITSUBISHI RAYON CO., LTD. (JP) 2012-06-07 US disclosed
US-8143407-B2 Process for production of heteroaryl-type boron compounds with iridium catalyst MITSUBISHI RAYON CO., LTD. (JP) 2012-03-27 US disclosed
EP-1481978-B1 PROCESS FOR PRODUCTION OF HETEROARYL-TYPE BORON COMPOUNDS WITH IRIDIUM CATALYST MITSUBISHI RAYON CO (JP) 2011-09-14 EP disclosed
US-20100010224-A1 PROCESS FOR PRODUCTION OF HETEROARYL-TYPE BORON COMPOUNDS WITH IRIDIUM CATALYST MITSUBISHI RAYON CO., LTD. (JP) 2010-01-14 US disclosed
US-7612218-B2 Process for production of heteroaryl-type boron compounds with iridium catalyst MITSUBISHI RAYON CO., LTD. (JP) 2009-11-03 US disclosed
US-20050148775-A1 Process for production of heteroaryl-type boron compounds with iridium catalyst MITSUBISHI RAYON CO., LTD. (JP) 2005-07-07 US disclosed
EP-1481978-A1 PROCESS FOR PRODUCTION OF HETEROARYL-TYPE BORON COMPOUNDS WITH IRIDIUM CATALYST Mitsubishi Rayon Co., Ltd. (JP) 2004-12-01 EP 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 (3 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-20100010224-A1 PROCESS FOR PRODUCTION OF HETEROARYL-TYPE BORON COMPOUNDS WITH IRIDIUM CATALYST PIN4, IPO5, HLCS NSD2 4529/4885MEN1 4048/4885KMT2A 3460/4885
US-20120142924-A1 PRODUCTION PROCESS OF A HETEROARYL-TYPE BORON COMPOUNDS WITH IRIDIUM CATALYST PIN4, NISCH, HLCS NSD2 4620/4885MEN1 3935/4885KMT2A 3775/4885
US-20050148775-A1 Process for production of heteroaryl-type boron compounds with iridium catalyst PIN4, IPO5, HLCS NSD2 4529/4885MEN1 4048/4885KMT2A 3460/4885

“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.