SCHEMBL30100694

SCHEMBL30100694

Cc1cc(C(N)=O)ccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 2/20 0.50
CDK8 P49336 2/20 0.50
PIK3CB P42338 1/20 0.49
PARP1 P09874 4/20 0.48
KDM4B O94953 1/20 0.47
KDM5C P41229 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
UHRF1 Q96T88 1/20 0.46
MKNK1 Q9BUB5 2/20 0.44
MKNK2 Q9HBH9 2/20 0.44
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42

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
SCHEMBL112539 1.00 CCNC (0.50) CCNCCDK8PIK3CBPARP1KDM4B
Hydrochloric Acid SCHEMBL5083661 0.98 CCNC (0.49) CCNCCDK8PIK3CBPARP1KDM4B
Formic Acid SCHEMBL27859414 0.93 CCNC (0.45) CCNCCDK8PIK3CBPARP1KDM4B
Butyramide SCHEMBL27726778 0.87 KDM4E (0.43) CCNCCDK8PIK3CBPARP1KDM4B
SCHEMBL11826813 0.83 MYC (0.40) CCNCCDK8PIK3CBPARP1KDM4B
SCHEMBL3356107 0.83 UHRF1 (0.50) CCNCCDK8PIK3CBKDM5CKDM5B
SCHEMBL29527921 0.81 KDM4C (0.61) KDM4BKDM5CKDM5BUHRF1GABRP
SCHEMBL353289 0.81 KDM4C (0.61) KDM4BKDM5CKDM5BUHRF1GABRP
SCHEMBL363432 0.81 UHRF1 (0.48) CCNCCDK8PIK3CBKDM5CKDM5B
SCHEMBL29580893 0.81 UHRF1 (0.48) CCNCCDK8PIK3CBKDM5CKDM5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110612285-B Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2023-04-04 CN claimed
CN-117561250-A Heterocyclic compound and harmful arthropod control composition containing same 住友化学株式会社 2024-02-13 CN disclosed
CN-117545356-A Heterocyclic compound and method for controlling drug-resistant harmful arthropods by using composition containing same 住友化学株式会社 2024-02-09 CN disclosed
CN-117479943-A EGFR inhibitors and PERK activators in combination therapies and use thereof for treating cancer 基因泰克公司 2024-01-30 CN disclosed
CN-116997542-A Phenylacetic acid derivatives, use thereof and intermediates for the manufacture thereof 住友化学株式会社 2023-11-03 CN disclosed
US-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 US disclosed
CN-110612285-B Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2023-04-04 CN disclosed
EP-4093400-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF The Trustees of Princeton University (US) 2022-11-30 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 (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-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 CCNC 4258/4885CDK8 1453/4885PIK3CB 1100/4885

“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.