SCHEMBL3661290

SCHEMBL3661290

NC(=O)c1cccc(-c2cn3ccccc3n2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.67
DYRK1A Q13627 1/20 0.67
KDM4E B2RXH2 11/20 0.66
RAB9A P51151 6/20 0.66
SMN1; SMN2 Q16637 5/20 0.66
LMNA P02545 3/20 0.66
POLB P06746 3/20 0.66
GFER P55789 3/20 0.66
NR4A2 P43354 1/20 0.62
ALDH1A1 P00352 10/20 0.62
KMT2A Q03164 3/20 0.60
MAPT P10636 2/20 0.60
CASP3 P42574 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59
MEN1 O00255 2/20 0.58
GAA P10253 2/20 0.58
MIF P14174 1/20 0.58
HPGD P15428 4/20 0.58

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
SCHEMBL25312971 0.87 KDM4E (0.71) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2
SCHEMBL29466392 0.87 KDM4E (0.71) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2
SCHEMBL25876071 0.86 KDM4E (0.73) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2
SCHEMBL3663283 0.86 CLK1 (0.66) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2
SCHEMBL25884758 0.83 KDM4E (0.62) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2
SCHEMBL15101533 0.83 SMN1; SMN2 (0.67) KDM4ERAB9ASMN1; SMN2LMNAPOLB
SCHEMBL25311377 0.83 KDM4E (0.62) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2
SCHEMBL25263897 0.83 KDM4E (0.65) KDM4ERAB9ASMN1; SMN2LMNAPOLB
SCHEMBL28933829 0.82 ALDH1A1 (0.78) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2
SCHEMBL25878920 0.82 KDM4E (0.67) CLK1DYRK1AKDM4ERAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240101552-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2024-03-28 US disclosed
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed
WO-2022057932-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF 上海医药集团股份有限公司 2022-03-24 WO disclosed
WO-2022057928-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF 上海医药集团股份有限公司 2022-03-24 WO disclosed
CN-114195780-A Carbonyl heterocyclic compound and application thereof 上海医药集团股份有限公司 2022-03-18 CN disclosed
CN-114195806-A Carbonyl heterocyclic compound and application thereof 上海医药集团股份有限公司 2022-03-18 CN disclosed
US-8642788-B2 Activators of executioner procaspases 3, 6 and 7 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-02-04 US disclosed
US-8486945-B2 Heterocyclic inhibitors of an Hh-signal cascade, medicinal compositions based thereon and methods for treating diseases caused by the aberrant activity of an Hh-signal system Ivachtchenko, Alexandre Vasilievich (US) 2013-07-16 US disclosed
EP-2237784-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 The Regents of the University of California (US) 2010-10-13 EP disclosed
WO-2009089508-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-07-16 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 (1 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-20240101552-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF LANCL2, CBS, LCP2 CLK1 1025/4885DYRK1A 4468/4885KDM4E 2757/4885

“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.