SCHEMBL10104599

SCHEMBL10104599

c1cc2cc(-c3cnn(CCOC4CCCCO4)c3)cnc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.51
KDM4C Q9H3R0 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TNIK Q9UKE5 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CDK8 P49336 4/20 0.38
AXL P30530 1/20 0.38
PIK3CA P42336 5/20 0.38
PIK3CD O00329 4/20 0.38
MTOR P42345 3/20 0.38
PIK3CB P42338 2/20 0.37
PIK3CG P48736 2/20 0.37
CD274 Q9NZQ7 1/20 0.37
RIPK1 Q13546 1/20 0.37
JAK2 O60674 2/20 0.36
MAP4K4 O95819 2/20 0.36
FGFR1 P11362 2/20 0.36
FLT1 P17948 2/20 0.36
MARK3 P27448 2/20 0.36

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
SCHEMBL10104598 0.81 MET (0.46) METKDM4CL3MBTL1ALKBRD4
SCHEMBL2697838 0.79 MET (0.50) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL13977686 0.79 MET (0.50) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL14783822 0.78 MET (0.53) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL14783752 0.78 MET (0.51) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL2699685 0.77 MET (0.47) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL15659168 0.77 MET (0.53) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL12524906 0.76 MET (0.49) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL27174578 0.76 MET (0.51) METKDM4CL3MBTL1NPC1RAB9A
SCHEMBL14059750 0.75 IKBKE (0.48) METAXLTYRO3IKBKE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210253571-A1 AZAINDOLE DERIVATIVE AND USE THEREOF AS FGFR AND C-MET INHIBITOR WUXI LIFE FOUNTAIN BIOTECH CO., LTD (CN) 2021-08-19 US disclosed
EP-3825314-A1 AZAINDOLE DERIVATIVE AND USE THEREOF AS FGFR AND C-MET INHIBITOR Medshine Discovery Inc. (CN) 2021-05-26 EP disclosed
WO-2020015744-A1 AZAINDOLE DERIVATIVE AND USE THEREOF AS FGFR AND C-MET INHIBITOR 南京明德新药研发有限公司 2020-01-23 WO disclosed
EP-2427461-B1 3-([1,2,3]TRIAZOL-4-YL)-PYRROLO[2,3-B]PYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2013-10-09 EP disclosed
US-8541584-B2 3-(1,2,3-triazol-4-yl) pyrrolo [2,3-b] pyridine derivatives MERCK PATENT GMBH (DE) 2013-09-24 US disclosed
US-8541584-B2 3-(1,2,3-triazol-4-yl) pyrrolo [2,3-b] pyridine derivatives MERCK PATENT GMBH (DE) 2013-09-24 US disclosed
US-20120053178-A1 3-(1,2,3-Triazol-4-yl) pyrrolo [2,3-b] pyridine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-03-01 US disclosed
US-20120053178-A1 3-(1,2,3-Triazol-4-yl) pyrrolo [2,3-b] pyridine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-03-01 US disclosed
WO-2010127754-A1 3-([1,2,3]TRIAZOLE-4-YL)-PYRROLO[2,3-B]PYRIDINE DERIVATES MERCK PATENT GMBH (DE) 2010-11-11 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-20210253571-A1 AZAINDOLE DERIVATIVE AND USE THEREOF AS FGFR AND C-MET INHIBITOR MET, FGFR1, FGFR2 MET 1/4885KDM4C 1633/4885L3MBTL1 3699/4885
US-20120053178-A1 3-(1,2,3-Triazol-4-yl) pyrrolo [2,3-b] pyridine derivatives PDK1, PDK2, PDK3 MET 1922/4885KDM4C 1532/4885L3MBTL1 1280/4885

“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.