SCHEMBL1911567

SCHEMBL1911567

CC(C)C(=O)c1cnccn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.57
NAPRT Q6XQN6 1/20 0.57
HCAR2 Q8TDS4 1/20 0.57
ADORA3 P0DMS8 1/20 0.55
TSHR P16473 1/20 0.55
MC4R P32245 1/20 0.55
ADRA1A P35348 1/20 0.55
MC3R P41968 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPK1 P28482 1/20 0.45
BAZ2B Q9UIF8 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
LMNA P02545 2/20 0.44
RECQL P46063 1/20 0.44
HIF1A Q16665 1/20 0.44
CYP2D6 P10635 1/20 0.44
HTT P42858 2/20 0.42
GAA P10253 2/20 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
SCHEMBL20705826 0.84 KDM4E (0.53) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL6187789 0.82 KDM4E (0.57) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL8225877 0.81 KDM4E (0.50) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL27668658 0.80 KDM4E (0.53) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL5578127 0.78 KDM4E (0.47) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL21254106 0.77 KDM4E (0.48) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL8509785 0.76 KDM4E (0.53) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL11868873 0.76 MAPT (0.47) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL11529414 0.76 SMN1; SMN2 (0.48) KDM4ENAPRTHCAR2ADORA3TSHR
SCHEMBL78340 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912668-B2 GCN2 and perk kinase inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2024-02-27 US disclosed
US-11912668-B2 GCN2 and perk kinase inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2024-02-27 US disclosed
WO-2024026484-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2023125825-A1 ANTICORONVIRAL COMPOUNDS AND COMPOSITIONS AND USES THEREOF SHANGHAI CUREGENE PHARMACEUTICAL CO., LTD. (CN) 2023-07-06 WO disclosed
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-25 US disclosed
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-25 US disclosed
US-20230037538-A1 ANTI-ALS COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-02-09 US disclosed
US-20230045142-A1 SMALL MOLECULE RPN13 INHIBITORS WITH ANTITUMOR PROPERTIES THE JOHNS HOPKINS UNIVERSITY (US) 2023-02-09 US disclosed
US-20220411426-A1 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-12-29 US disclosed
US-11124498-B2 Compositions and methods for modulating protease activity THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-09-21 US disclosed
US-20070282100-A1 Boronic ester and acid compounds, synthesis and uses MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-12-06 US disclosed
US-20070282100-A1 Boronic ester and acid compounds, synthesis and uses MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-12-06 US disclosed
US-20070281885-A1 MACROCYLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-20070281885-A1 MACROCYLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-20070167456-A1 Mercaptoimidazoles as ccr2 receptor antagonists LOMMEN GUY R E 2007-07-19 US disclosed
US-20070167456-A1 Mercaptoimidazoles as ccr2 receptor antagonists LOMMEN GUY R E 2007-07-19 US disclosed
US-4975112-A STEREOISOMERS IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1990-12-04 US disclosed
EP-0119718-B1 SMOKING COMPOSITIONS CONTAINING A NOVEL MONOACYLPYRAZINE FLAVORANT Philip Morris Products Inc. (US) 1989-05-10 EP disclosed
EP-0296722-A1 Pyrazine derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-12-28 EP disclosed
EP-0076085-A1 Production of monoacylpyrazines PHILIP MORRIS INCORPORATED (US) 1983-04-06 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 (9 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-20070281885-A1 MACROCYLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS HCCS, CPN1, HPN KDM4E 893/4885NAPRT 2024/4885HCAR2 2690/4885
US-20230037538-A1 ANTI-ALS COMPOUNDS TARDBP, GRN, NLN KDM4E 3351/4885NAPRT 3684/4885HCAR2 3322/4885
US-20070282100-A1 Boronic ester and acid compounds, synthesis and uses BCL6, BCAP31, CD79B KDM4E 3575/4885NAPRT 618/4885HCAR2 1026/4885
US-20220411426-A1 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF IDE, SI, GPR119 KDM4E 2169/4885NAPRT 1109/4885HCAR2 1037/4885
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF RIPK1, RIPK3, RIPK4 KDM4E 3571/4885NAPRT 2775/4885HCAR2 1687/4885
US-11124498-B2 Compositions and methods for modulating protease activity RNASE1, ADAM8, CTRL KDM4E 3253/4885NAPRT 3686/4885HCAR2 4328/4885
US-11912668-B2 GCN2 and perk kinase inhibitors and methods of use thereof EIF2AK4, GCN1, MAPKAPK2 KDM4E 4410/4885NAPRT 3615/4885HCAR2 2984/4885
US-20070167456-A1 Mercaptoimidazoles as ccr2 receptor antagonists CCR2, CCR1, CCR5 KDM4E 3601/4885NAPRT 569/4885HCAR2 84/4885
US-20230045142-A1 SMALL MOLECULE RPN13 INHIBITORS WITH ANTITUMOR PROPERTIES MRPS23, RPP30, RPS19 KDM4E 1851/4885NAPRT 3200/4885HCAR2 4849/4885

“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.