SCHEMBL467555

SCHEMBL467555

O=C1CCc2cc[c]nc2N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
MAPK14 Q16539 1/20 0.41
PDE3B Q13370 3/20 0.38
PDE3A Q14432 3/20 0.38
CRBN Q96SW2 6/20 0.37
CA9 Q16790 1/20 0.37
SRD5A1 P18405 5/20 0.35
TBXAS1 P24557 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
KIF11 P52732 1/20 0.32
DDB1 Q16531 1/20 0.32
MAPT P10636 2/20 0.32

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
SCHEMBL4132924 0.72 PDE3B (0.50) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL247150 0.69 CRBN (0.50) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL171558 0.69 NNMT (0.35) CA9MAPTALDH1A1HTT
SCHEMBL633656 0.69 MMP12 (0.39) CYP11B1CYP11B2MAPTALDH1A1SMN1; SMN2
SCHEMBL632922 0.69 MAOB (0.40) PDE3BPDE3ACYP11B1CYP11B2MAOA
SCHEMBL5371747 0.68 PDE3B (0.43) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL21671865 0.68 PDE3B (0.43) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL18202413 0.68 PDE3B (0.43) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL4148301 0.68 PDE3B (0.43) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5366571 0.68 CA9 (0.47) NPC1MAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2022793-B1 NOVEL HETEROCYCLIC COMPOUND OR SALT THEREOF AND INTERMEDIATE THEREOF TOYAMA CHEMICAL CO LTD (JP) 2014-06-04 EP claimed
US-20090143355-A1 Substituted aryl-amine derivatives and methods of use AMGEN INC. (US) 2009-06-04 US claimed
EP-1773817-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2007-04-18 EP claimed
US-20060040966-A1 e.g. 2-(7-isoquinolinylamino)-N-(3-methyl-4-(1-methylethyl)phenyl)-3-pyridinecarboxamide; Vascular Endothelial Growth Factor antagonist; angiogenesis inhibitor; anticarcinogenic, antiinflammatory inhibitor; retinopathies, rheumatoid arthritis, asthma, atherosclerosis, endometriosis, neoplastic diseases AMGEN INC. 2006-02-23 US claimed
WO-2006012374-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2006-02-02 WO claimed
WO-2023247769-A1 DOSAGE REGIMEN FOR AXL INHIBITOR BERGENBIO ASA (NO) 2023-12-28 WO disclosed
US-20230372337-A1 Combination Therapy Comprising an AXL Inhibitor BERGENBIO ASA (NO) 2023-11-23 US disclosed
US-20230250169-A1 AXL Inhibitors for Antiviral Therapy BERGENBIO ASA (NO) 2023-08-10 US disclosed
US-20230149397-A1 Combination Therapy with AXL Inhibitor and Immune Checkpoint Modulator or Oncolytic Virus BERGENBIO ASA (NO) 2023-05-18 US disclosed
US-20230151100-A1 Method of Selecting Patients for Treatment with a Combination of an AXL Inhibitor and an Immune Checkpoint Modulator BERGENBIO ASA (NO) 2023-05-18 US disclosed
CN-116075303-A Method of selecting patients treated with a combination of an AXL inhibitor and an immune checkpoint modulator 卑尔根生物股份公司 2023-05-05 CN disclosed
CN-115916344-A AXL inhibitors for antiviral therapy 卑尔根生物股份公司 2023-04-04 CN disclosed
EP-2022793-A1 NOVEL HETEROCYCLIC COMPOUND OR SALT THEREOF AND INTERMEDIATE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-02-11 EP disclosed
EP-1773817-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2007-04-18 EP disclosed
EP-1578743-A4 ANTIBACTERIAL AGENTS GLAXO GROUP LTD (GB) 2006-11-29 EP disclosed
US-20060040966-A1 e.g. 2-(7-isoquinolinylamino)-N-(3-methyl-4-(1-methylethyl)phenyl)-3-pyridinecarboxamide; Vascular Endothelial Growth Factor antagonist; angiogenesis inhibitor; anticarcinogenic, antiinflammatory inhibitor; retinopathies, rheumatoid arthritis, asthma, atherosclerosis, endometriosis, neoplastic diseases AMGEN INC. 2006-02-23 US disclosed
US-20060041123-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-02-23 US disclosed
WO-2006012374-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2006-02-02 WO disclosed
EP-1578743-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2005-09-28 EP disclosed
WO-2004058144-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2004-07-15 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 (7 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-20230149397-A1 Combination Therapy with AXL Inhibitor and Immune Checkpoint Modulator or Oncolytic Virus AXL, CD274, HAVCR2 NPC1 4279/4885MAPK13 1113/4885MAPK12 702/4885
US-20230372337-A1 Combination Therapy Comprising an AXL Inhibitor AXL, CD274, CD47 NPC1 3993/4885MAPK13 541/4885MAPK12 457/4885
US-20230250169-A1 AXL Inhibitors for Antiviral Therapy FLT3, AXL, SARS1 NPC1 3675/4885MAPK13 1232/4885MAPK12 1491/4885
US-20060041123-A1 Antibacterial agents NQO2, NRDC, IFNG NPC1 660/4885MAPK13 3490/4885MAPK12 2343/4885
US-20060040966-A1 e.g. 2-(7-isoquinolinylamino)-N-(3-methyl-4-(1-methylethyl)phenyl)-3-pyridinecarboxamide; Vascular Endothelial Growth Factor antagonist; angiogenesis inhibitor; anticarcinogenic, antiinflammatory inhibitor; retinopathies, rheumatoid arthritis, asthma, atherosclerosis, endometriosis, neoplastic diseases EDNRA, PTGIS, EDNRB NPC1 2638/4885MAPK13 2600/4885MAPK12 2403/4885
US-20230151100-A1 Method of Selecting Patients for Treatment with a Combination of an AXL Inhibitor and an Immune Checkpoint Modulator STK11, MERTK, AXL NPC1 3786/4885MAPK13 463/4885MAPK12 300/4885
US-20090143355-A1 Substituted aryl-amine derivatives and methods of use FLT1, FLT4, NAT1 NPC1 842/4885MAPK13 2853/4885MAPK12 2404/4885

“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.