SCHEMBL741042

SCHEMBL741042

Cc1ccnc2ccc(Br)cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 5/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
CCNC P24863 2/20 0.48
CDK8 P49336 2/20 0.48
NCF1 P14598 1/20 0.47
GAK O14976 1/20 0.46
EPHB6 O15197 1/20 0.46
RIPK2 O43353 1/20 0.46
STK16 O75716 1/20 0.46
ABL1 P00519 1/20 0.46
ACVR1 Q04771 1/20 0.46
AAK1 Q2M2I8 1/20 0.46
COQ8A Q8NI60 1/20 0.46
NLK Q9UBE8 1/20 0.46
HTT P42858 4/20 0.45
LMNA P02545 1/20 0.45
CHEK1 O14757 1/20 0.44
PIM1 P11309 1/20 0.44
AKT1 P31749 1/20 0.44
FLT3 P36888 1/20 0.44

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
SCHEMBL28650060 0.87 SLC22A12 (0.49) SLC22A12SMN1; SMN2CCNCCDK8NCF1
SCHEMBL30390607 0.84 ALK (0.50) SLC22A12SMN1; SMN2CCNCCDK8NCF1
SCHEMBL1496382 0.84 ALK (0.50) SLC22A12SMN1; SMN2CCNCCDK8NCF1
SCHEMBL14690611 0.79 SLC22A12 (0.51) SLC22A12SMN1; SMN2CCNCCDK8NCF1
SCHEMBL29896761 0.79 SLC22A12 (0.51) SLC22A12SMN1; SMN2CCNCCDK8NCF1
SCHEMBL29847401 0.79 HTR1A (0.58) SLC22A12SMN1; SMN2HTTLMNAALDH1A1
SCHEMBL873431 0.79 HTR1A (0.58) SLC22A12SMN1; SMN2HTTLMNAALDH1A1
SCHEMBL358762 0.77 GAK (0.61) SLC22A12NCF1GAKEPHB6RIPK2
SCHEMBL827782 0.76 NR4A2 (0.61) SMN1; SMN2CCNCCDK8GAKRIPK2
SCHEMBL359558 0.76 NT5E (0.50) SLC22A12SMN1; SMN2CCNCCDK8NCF1

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 79 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110437143-B Benzyl substituted quinoline and derivative and synthesis method thereof 湘潭大学 2022-08-09 CN claimed
CN-109776406-B Method for cross coupling of ether compound and quinoline derivative 湘潭大学 2021-05-04 CN claimed
CN-119931978-A Application of monoamine oxidase as catalyst in preparation of quinoline nitrogen heterocyclic compound 河北工业大学 2025-05-06 CN disclosed
US-20250122203-A1 ADENOSINE RECEPTOR ANTAGONISTS CROSSIGNAL THERAPEUTICS, INC. 2025-04-17 US disclosed
CN-113347965-B TGF-beta inhibitors and prodrugs 生物医学研究机构基金会 2025-02-18 CN disclosed
EP-4433485-A1 ADENOSINE RECEPTOR ANTAGONISTS Crossignal Therapeutics, Inc. (US) 2024-09-25 EP disclosed
US-12065444-B2 Substituted tetrazolo[1,5-a]pyrazines and tetrazolo[1,5-c]pyrimidines as adenosine receptor antagonists CROSSIGNAL THERAPEUTICS, INC. (US) 2024-08-20 US disclosed
CN-118317965-A Adenosine receptor antagonists 交信医药研发公司 2024-07-09 CN disclosed
CN-116376858-A Application of monoamine oxidase from microorganism as catalyst in preparation of quinoline or quinoline derivative 浙江大学杭州国际科创中心 2023-07-04 CN disclosed
WO-2023091604-A1 ADENOSINE RECEPTOR ANTAGONISTS CROSSIGNAL THERAPEUTICS, INC. (US) 2023-05-25 WO disclosed
US-20230159541-A1 ADENOSINE RECEPTOR ANTAGONISTS CROSSIGNAL THERAPEUTICS, INC. 2023-05-25 US disclosed
EP-1565471-B1 QUINOLINYL-PYRROLOPYRAZOLES LILLY CO ELI (US) 2006-10-04 EP disclosed
CN-1269820-C Novel pyrrole derivatives as medicaments LILLY CO ELI (US) 2006-08-16 CN disclosed
US-7087626-B2 Pyrrole derivatives as pharmaceutical agents ELI LILLY AND COMPANY (US) 2006-08-08 US disclosed
US-20060040983-A1 Quinolinyl-pyrrolopyrazoles ELI LILLY AND COMPANY (US) 2006-02-23 US disclosed
EP-1565471-A1 QUINOLINYL-PYRROLOPYRAZOLES ELI LILLY AND COMPANY (US) 2005-08-24 EP disclosed
US-20050112770-A1 Method for optical measurement of multi-stranded nucleic acid FUJI PHOTO FILM CO., LTD. 2005-05-26 US disclosed
CN-1511157-A Novel pyrrole derivatives as medicaments 2004-07-07 CN disclosed
WO-2004048382-A1 QUINOLINYL-PYRROLOPYRAZOLES ELI LILLY AND COMPANY (US) 2004-06-10 WO disclosed
EP-1362894-A2 Method for optical measurement of multi-stranded nucleic acid using cyanine dyes FUJI PHOTO FILM CO., LTD. (JP) 2003-11-19 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 (4 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-20060040983-A1 Quinolinyl-pyrrolopyrazoles SDHA, NQO2, SDHB SLC22A12 507/4885SMN1; SMN2 1609/4885CCNC 595/4885
US-20250122203-A1 ADENOSINE RECEPTOR ANTAGONISTS ADORA2A, ADORA1, ADORA3 SLC22A12 1945/4885SMN1; SMN2 1547/4885CCNC 3736/4885
US-20230159541-A1 ADENOSINE RECEPTOR ANTAGONISTS ADORA2A, ADORA1, ADORA3 SLC22A12 1945/4885SMN1; SMN2 1547/4885CCNC 3736/4885
US-12065444-B2 Substituted tetrazolo[1,5-a]pyrazines and tetrazolo[1,5-c]pyrimidines as adenosine receptor antagonists ADORA2A, ADORA1, P2RX5 SLC22A12 2201/4885SMN1; SMN2 2925/4885CCNC 2250/4885

“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.