SCHEMBL20768111

SCHEMBL20768111

CC(CCCN(C)C)Nc1ccnc2cc(Cl)ccc12

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.79
CHRM2 P08172 2/20 0.79
CHRM4 P08173 2/20 0.79
CHRM5 P08912 2/20 0.79
ADRA2A P08913 2/20 0.79
CHRM1 P11229 2/20 0.79
ADRA2B P18089 2/20 0.79
ADRA2C P18825 2/20 0.79
CHRM3 P20309 2/20 0.79
KCNH2 Q12809 2/20 0.79
TMEM97 Q5BJF2 2/20 0.79
SIGMAR1 Q99720 2/20 0.79
ACE2 Q9BYF1 2/20 0.79
CYP2D6 P10635 1/20 0.79
CYP2C19 P33261 1/20 0.79
TDP1 Q9NUW8 1/20 0.79
PRNP P04156 1/20 0.79
APP P05067 1/20 0.79
NQO2 P16083 1/20 0.79
MTOR P42345 1/20 0.79

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
SCHEMBL29421608 1.00 NR4A2 (0.79) NR4A2CHRM2CHRM4CHRM5ADRA2A
SCHEMBL15483222 0.93 CHRM2 (0.79) NR4A2CHRM2CHRM4CHRM5ADRA2A
SCHEMBL30817262 0.93 NR4A2 (0.71) NR4A2CHRM2CHRM4CHRM5ADRA2A
Pyrophosphoric Acid SCHEMBL29578167 0.90 KDM4E (0.73) NR4A2CHRM2CHRM4CHRM5ADRA2A
SCHEMBL14580289 0.90 CHRM2 (0.82) NR4A2CHRM2CHRM4CHRM5ADRA2A
Chloroquine SCHEMBL8934 0.88 CHRM2 (1.00) NR4A2CHRM2CHRM4CHRM5ADRA2A
Chloroquine SCHEMBL29363614 0.88 CHRM2 (1.00) NR4A2CHRM2CHRM4CHRM5ADRA2A
(R)-Chloroquine SCHEMBL29429108 0.88 CHRM2 (1.00) NR4A2CHRM2CHRM4CHRM5ADRA2A
(R)-Chloroquine SCHEMBL134500 0.88 CHRM2 (1.00) NR4A2CHRM2CHRM4CHRM5ADRA2A
Chloroquine SCHEMBL8474661 0.88 CHRM2 (1.00) NR4A2CHRM2CHRM4CHRM5ADRA2A

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
US-20220112625-A1 Diagnosing and Treating Neurological and Autoimmune Diseases by Optimizing Metabolic Responses POSTREL RICHARD (US) 2022-04-14 US claimed
US-20190070166-A1 Optimized Method for Treating and Curing Arthritis, Diabetes, Multiple Sclerosis and Other Autoimmune Disease POSTREL RICHARD (US) 2019-03-07 US claimed
CN-115232015-A Synthetic method of chloroquine chiral side chain 暨明医药科技(苏州)有限公司 2022-10-25 CN disclosed
CN-114796520-A anti-CD 74 antibody conjugates, compositions comprising anti-CD 74 antibody conjugates, and methods of use of anti-CD 74 antibody conjugates 苏特罗生物制药公司 2022-07-29 CN disclosed
CN-114746420-A 1- (4- (aminomethyl) benzyl) -2-butyl-2H-pyrazolo [3,4-c ] quinolin-4-amine derivatives as Toll-like receptor (TLR)7/8 agonists and related compounds and antibody drug conjugates thereof for cancer therapy and diagnosis 苏特罗生物制药公司 2022-07-12 CN disclosed
US-20220112625-A1 Diagnosing and Treating Neurological and Autoimmune Diseases by Optimizing Metabolic Responses POSTREL RICHARD (US) 2022-04-14 US disclosed
CN-114269749-A 5H-pyrrolo [3,2-d ] pyrimidine-2, 4-diamino compounds and antibody conjugates thereof 苏特罗生物制药公司 2022-04-01 CN disclosed
CN-114206392-A Immunomodulatory agent antibody drug conjugates and uses thereof 苏特罗生物制药公司 2022-03-18 CN disclosed
CN-112313336-A Method for optimizing antibody expression AMBRX公司 2021-02-02 CN disclosed
US-20190070166-A1 Optimized Method for Treating and Curing Arthritis, Diabetes, Multiple Sclerosis and Other Autoimmune Disease POSTREL RICHARD (US) 2019-03-07 US disclosed