SCHEMBL8319246

SCHEMBL8319246

Cn1c2c(c(=O)[nH]c1=O)CN(Cc1ccccc1)CC2

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 1/20 0.56
CLPP Q16740 12/20 0.51
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
ACHE P22303 2/20 0.48
GABRA1 P14867 1/20 0.46
GABRA2 P47869 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46

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 SCHEMBL8327802 0.99 SLC6A5 (0.55) SLC6A5CLPPKDM4EALDH1A1ACHE
SCHEMBL8323169 0.80 ACHE (0.57) SLC6A5KDM4EALDH1A1ACHEGABRA1
SCHEMBL8319661 0.79 CLPP (0.54) CLPPKDM4EALDH1A1ACHEHDAC10
Hydrochloric Acid SCHEMBL8323662 0.79 ACHE (0.56) SLC6A5ACHEGABRA1GABRA2
Hydrochloric Acid SCHEMBL8321634 0.78 CLPP (0.53) CLPPKDM4EALDH1A1ACHEHDAC10
SCHEMBL20495944 0.76 HDAC6 (0.61) HDAC10HDAC8HDAC6
SCHEMBL2625346 0.75 SLC6A5 (0.80) SLC6A5CLPPKDM4EALDH1A1ACHE
SCHEMBL19667094 0.74 SLC6A5 (0.56) SLC6A5CLPPKDM4EALDH1A1ACHE
SCHEMBL27224412 0.74 SLC6A5 (0.62) SLC6A5CLPPKDM4EALDH1A1ACHE
SCHEMBL8324851 0.72 ACHE (0.55) SLC6A5KDM4EALDH1A1ACHEGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109715162-B Protein kinase modulators 南京盖特医药技术有限公司 2025-03-21 CN disclosed
US-11091477-B2 Protein kinase regulators Madera Therapeutics, LLC (US) 2021-08-17 US disclosed
US-11091477-B2 Protein kinase regulators Madera Therapeutics, LLC (US) 2021-08-17 US disclosed
US-20200181139-A1 Protein Kinase Regulators Madera Therapeutics, LLC 2020-06-11 US disclosed
US-20200181139-A1 Protein Kinase Regulators Madera Therapeutics, LLC 2020-06-11 US disclosed
WO-2004014384-A2 CYCLIC COMPOUNDS CONTAINING ZINC BINDING GROUPS AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO disclosed
WO-2004014909-A1 FUSED TETRAHYDROPYRIDINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO disclosed
EP-0621037-B1 Pyrido-pyrimidinediones, process for their preparation and their use as pharmaceuticals HOECHST AG (DE) 1999-07-07 EP disclosed
US-5556854-A CARDIOVASCULAR DISORDERS AND/OR NEUROGENERATIVE DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1996-09-17 US disclosed
EP-0621037-A1 Pyrido-pyrimidinediones, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-26 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 (2 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-11091477-B2 Protein kinase regulators MAP3K1, MAP3K6, MAP3K20 SLC6A5 4650/4885CLPP 1459/4885KDM4E 2313/4885
US-20200181139-A1 Protein Kinase Regulators MAP3K1, MAP3K6, MAP3K20 SLC6A5 4650/4885CLPP 1459/4885KDM4E 2313/4885

“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.