SCHEMBL2800814

SCHEMBL2800814

CC(C)(C)OC(=O)N1CCC(n2cc(-c3cnc4cccc(Br)c4n3)cn2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.54
FGFR1 P11362 3/20 0.54
FGFR2 P21802 3/20 0.54
FGFR3 P22607 3/20 0.54
FGFR4 P22455 2/20 0.54
FLT3 P36888 2/20 0.54
MET P08581 4/20 0.52
TNK2 Q07912 1/20 0.47
DDB1 Q16531 1/20 0.47
CRBN Q96SW2 1/20 0.47
TTK P33981 2/20 0.45
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
LIPC P11150 1/20 0.43
JAK2 O60674 2/20 0.43
JAK3 P52333 2/20 0.43
ABL1 P00519 1/20 0.43
JAK1 P23458 1/20 0.43
TYK2 P29597 1/20 0.43
RIPK2 O43353 1/20 0.43

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
SCHEMBL24290582 0.95 KDR (0.49) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL27091084 0.91 FGFR3 (0.45) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL2800288 0.90 FGFR3 (0.46) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL24290153 0.88 MET (0.49) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL24288969 0.87 FGFR1 (0.63) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL2799229 0.87 PIK3CA (0.49) KDRMETJAK2JAK3ABL1
SCHEMBL27776919 0.87 KDR (0.41) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL24290552 0.86 FGFR1 (0.51) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL27090952 0.86 MET (0.51) KDRFGFR1FGFR2FGFR3FGFR4
SCHEMBL2798778 0.85 BCL2L1 (0.45) KDRFGFR1FGFR2FGFR3FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-15 US disclosed
CN-116583509-A Compounds and methods for treating cancer 上海睿跃生物科技有限公司 2023-08-11 CN disclosed
CN-116323570-A Compounds and methods for treating diseases 上海睿跃生物科技有限公司 2023-06-23 CN disclosed
WO-2022073469-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI) , INC. (CN) 2022-04-14 WO disclosed
EP-2155201-B1 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES NOVARTIS AG (CH) 2012-08-01 EP disclosed
EP-2155201-B1 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES NOVARTIS AG (CH) 2012-08-01 EP disclosed
US-8193189-B2 Quinoxaline derivatives as tyrosine kinase activity inhibitors NOVARTIS AG (CH) 2012-06-05 US disclosed
US-8193189-B2 Quinoxaline derivatives as tyrosine kinase activity inhibitors NOVARTIS AG (CH) 2012-06-05 US disclosed
US-8193189-B2 Quinoxaline derivatives as tyrosine kinase activity inhibitors NOVARTIS AG (CH) 2012-06-05 US disclosed
US-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors NOVARTIS AG 2010-07-01 US disclosed
US-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors NOVARTIS AG 2010-07-01 US disclosed
US-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors NOVARTIS AG 2010-07-01 US disclosed
EP-2155201-A2 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES Novartis Ag (CH) 2010-02-24 EP disclosed
WO-2008148867-A2 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES NOVARTIS AG (CH) 2008-12-11 WO disclosed
WO-2008148867-A2 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES NOVARTIS AG (CH) 2008-12-11 WO 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-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors JAK2, JAK1, JAK3 KDR 407/4885FGFR1 535/4885FGFR2 876/4885
US-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS GSPT1, GGT1, VHL KDR 2919/4885FGFR1 287/4885FGFR2 1049/4885

“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.