SCHEMBL28060360

SCHEMBL28060360

CC1=NC(C)(C(N)=O)CS1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 1/20 0.36
GABRB2 P47870 1/20 0.36
PKM P14618 1/20 0.30

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
SCHEMBL5711263 0.82 GABRA5 (0.37) GABRA5GABRB2
SCHEMBL28324279 0.77 GABRA5 (0.34) GABRA5GABRB2
SCHEMBL13278423 0.66
SCHEMBL10425492 0.64
SCHEMBL5711305 0.64 GABRA5 (0.56) GABRA5GABRB2
SCHEMBL18612449 0.60
SCHEMBL27886750 0.57 GABRA5 (0.49) GABRA5GABRB2
SCHEMBL18612543 0.57
SCHEMBL18612452 0.57
SCHEMBL3008261 0.57

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109743875-A The inhibitor of MENIN-MLL interaction 生命医药公司 2019-05-10 CN claimed
CN-105745214-B Tricyclic piperidine compounds 埃科特莱茵药品有限公司 2019-02-19 CN claimed
CN-110036015-A It can be used as the Imidazopyridazine compounds of the regulator of IL-12, IL-23 and/or IFN α response 百时美施贵宝公司 2019-07-19 CN disclosed
CN-109743875-A The inhibitor of MENIN-MLL interaction 生命医药公司 2019-05-10 CN disclosed
CN-105745214-B Tricyclic piperidine compounds 埃科特莱茵药品有限公司 2019-02-19 CN disclosed
CN-109071526-A The acid-addition salts of bridged piperazine derivatives 阿森纽荣股份公司 2018-12-21 CN disclosed
CN-108929336-A Thiazolopyrimidinone class as the active regulator of nmda receptor 豪夫迈·罗氏有限公司 2018-12-04 CN disclosed
CN-105612162-B Thiazolopyrimidinones as modulators of NMDA receptor activity 豪夫迈·罗氏有限公司 2018-08-21 CN disclosed
CN-108137588-A Tricyclic condensed pyridin-2-ones derivative and its purposes as BRD4 inhibitor 朱比兰特生物系统有限公司 2018-06-08 CN disclosed
CN-104254533-B The pyridinyl compounds of thiazole or thiadiazoles substitution as kinase inhibitor 百时美施贵宝公司 2017-09-08 CN disclosed
CN-104169275-B The pyridine compounds of the triazole substitution as kinase inhibitor 百时美施贵宝公司 2017-06-09 CN disclosed
CN-104159896-B Heterocyclic-substituted pyridyl compounds useful as kinase inhibitors 百时美施贵宝公司 2017-05-24 CN disclosed
CN-105612162-A Thiazolopyrimidinones as modulators of NMDA receptor activity HOFFMANN LA ROCHE 2016-05-25 CN disclosed