SCHEMBL1665468

SCHEMBL1665468

Cc1ccn(C)c1C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.38
BRD9 Q9H8M2 1/20 0.38
KDM4E B2RXH2 3/20 0.36
KDM6A O15550 1/20 0.36
KDM4A O75164 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KDM5C P41229 1/20 0.36
KDM2B Q8NHM5 1/20 0.36
DOHH Q9BU89 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
BRPF1 P55201 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
SIRT3 Q9NTG7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CCNC P24863 1/20 0.33

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
Hydrochloric Acid SCHEMBL28139132 0.98 BRD4 (0.37) BRD4BRD9KDM4EKDM6AKDM4A
SCHEMBL866606 0.80 ALDH1A1 (0.39) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL28668408 0.80 KMT2A (0.38) BRD4KDM4EKDM6AKDM4ACYP2C9
SCHEMBL4051027 0.78 MEN1 (0.35) BRD4BRD9KDM4ECYP2C19SMN1; SMN2
SCHEMBL25072434 0.78 KDM4E (0.35) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL31201169 0.77 PKM (0.36) BRD4KDM4EKDM6AKDM4ACYP2C9
SCHEMBL16992853 0.77 MAP2K1 (0.34) BRD4KDM4EKDM6AKDM4ACYP2C9
SCHEMBL31710685 0.77 AR (0.33) BRD4BRD9KDM4EKDM6AKDM4A
SCHEMBL11286998 0.75 KDM4E (0.46) BRD4KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL4649779 0.75 BRD4 (0.42) BRD4BRD9KDM4EKDM6AKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106674201-A Pyrrole compounds, method of preparing same and pharmaceutical compositions containing the compounds 法国施维雅药厂 2017-05-17 CN claimed
EP-1896454-A1 AMlNO-5-(5-MEMBERED)HETEROARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR -SECRETASE MODULATION Wyeth a Corporation of the State of Delaware (US) 2008-03-12 EP claimed
WO-2007005366-A1 AMlNO-5-(5-MEMBERED)HETEROARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR β-SECRETASE MODULATION WYETH (US) 2007-01-11 WO claimed
US-12599582-B2 Pyrrole compounds ALIGOS THERAPEUTICS, INC. (US) 2026-04-14 US disclosed
US-20230390242-A1 PYRROLE COMPOUNDS ALIGOS THERAPEUTICS, INC. 2023-12-07 US disclosed
US-11771680-B2 Pyrrole compounds ALIGOS THERAPEUTICS, INC. (US) 2023-10-03 US disclosed
US-20220071957-A1 PYRROLE COMPOUNDS EMORY UNIVERSITY 2022-03-10 US disclosed
US-11191747-B2 Pyrrole compounds ALIGOS THERAPEUTICS, INC. (US) 2021-12-07 US disclosed
US-20200323821-A1 PYRROLE COMPOUNDS EMORY UNIVERSITY 2020-10-15 US disclosed
EP-3700911-A1 NOVEL MACROCYCLIC DERIVATIVES, PROCESS FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Les Laboratoires Servier SAS (FR) 2020-09-02 EP disclosed
EP-2491039-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS Cellzome Limited (GB) 2012-08-29 EP disclosed
WO-2011048082-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2011-04-28 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 (6 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-20230390242-A1 PYRROLE COMPOUNDS PKD1, ADCYAP1R1, PYCR1 BRD4 1834/4885BRD9 2456/4885KDM4E 2319/4885
US-12599582-B2 Pyrrole compounds PEF1, CYP4F8, CYP2C19 BRD4 4152/4885BRD9 3234/4885KDM4E 1162/4885
US-11771680-B2 Pyrrole compounds PKD1, ADCYAP1R1, PYCR1 BRD4 1834/4885BRD9 2456/4885KDM4E 2319/4885
US-20200323821-A1 PYRROLE COMPOUNDS PKD1, ADCYAP1R1, PYCR1 BRD4 1834/4885BRD9 2456/4885KDM4E 2319/4885
US-20220071957-A1 PYRROLE COMPOUNDS PKD1, ADCYAP1R1, PYCR1 BRD4 1834/4885BRD9 2456/4885KDM4E 2319/4885
US-11191747-B2 Pyrrole compounds PKD1, ADCYAP1R1, PYCR1 BRD4 1834/4885BRD9 2456/4885KDM4E 2319/4885

“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.