SCHEMBL467615

SCHEMBL467615

N#C/N=C(/Nc1ccc2c(c1)CCC(N1CCCC1)CC2)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.42
ADRA2A P08913 1/20 0.37
CYP2D6 P10635 2/20 0.37
AXL P30530 3/20 0.36
AURKA O14965 1/20 0.36
EGFR P00533 1/20 0.36
RET P07949 1/20 0.36
MET P08581 1/20 0.36
KIT P10721 1/20 0.36
SRC P12931 1/20 0.36
PDGFRA P16234 1/20 0.36
KDR P35968 1/20 0.36
FLT3 P36888 1/20 0.36
TYRO3 Q06418 1/20 0.36
DDR1 Q08345 1/20 0.36
MERTK Q12866 1/20 0.36
AURKB Q96GD4 1/20 0.36
ALK Q9UM73 1/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 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
SCHEMBL19633153 1.00 HRH3 (0.42) HRH3ADRA2ACYP2D6AXLAURKA
SCHEMBL1638512 1.00 HRH3 (0.42) HRH3ADRA2ACYP2D6AXLAURKA
SCHEMBL1638017 1.00 HRH3 (0.42) HRH3ADRA2ACYP2D6AXLAURKA
SCHEMBL467616 1.00 HRH3 (0.42) HRH3ADRA2ACYP2D6AXLAURKA
SCHEMBL2056692 0.84 ADRA2A (0.38) ADRA2ANPC1RAB9AMEN1KMT2A
SCHEMBL467520 0.84 ADRA2A (0.38) ADRA2ANPC1RAB9AMEN1KMT2A
SCHEMBL13229436 0.84 HRH3 (0.42) HRH3ADRA2ACYP2D6AXLAURKA
SCHEMBL18507673 0.83 MAPK14 (0.40) HRH3CYP2D6TP53GRIN2B
SCHEMBL13211824 0.82 MCHR1 (0.37) ADRA2ANPC1RAB9AMEN1KMT2A
SCHEMBL4987913 0.81 NPY2R (0.44) AXLEGFRMEN1KMT2ANPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3889148-A1 AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\" IN PURIFIED FORM BerGenBio ASA (NO) 2021-10-06 EP claimed
EP-3218367-B1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BERGENBIO ASA (NO) 2021-05-19 EP claimed
US-9994553-B2 Process for the purification of the Axl tyrosine receptor kinase inhibitor “R428” BERGENBIO AS (NO) 2018-06-12 US claimed
US-20170334884-A1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BERGENBIO ASA (NO) 2017-11-23 US claimed
EP-3218367-A1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BerGenBio AS (NO) 2017-09-20 EP claimed
WO-2016075477-A9 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BERGENBIO AS (NO) 2017-07-06 WO claimed
WO-2016075477-A1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BERGENBIO AS (NO) 2016-05-19 WO claimed
US-20210379064-A1 AXL INHIBITORS FOR USE IN COMBINATION THERAPY FOR PREVENTING, TREATING OR MANAGING METASTATIC CANCER MIDCAP FINANCIAL TRUST 2021-12-09 US disclosed
US-20210379064-A1 AXL INHIBITORS FOR USE IN COMBINATION THERAPY FOR PREVENTING, TREATING OR MANAGING METASTATIC CANCER MIDCAP FINANCIAL TRUST 2021-12-09 US disclosed
EP-3889148-A1 AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\" IN PURIFIED FORM BerGenBio ASA (NO) 2021-10-06 EP disclosed
EP-3218367-B1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BERGENBIO ASA (NO) 2021-05-19 EP disclosed
US-20190336500-A1 AXL INHIBITORS FOR USE IN COMBINATION THERAPY FOR PREVENTING, TREATING OR MANAGING METASTATIC CANCER RIGEL PHARMACEUTICALS, INC. 2019-11-07 US disclosed
US-20190336500-A1 AXL INHIBITORS FOR USE IN COMBINATION THERAPY FOR PREVENTING, TREATING OR MANAGING METASTATIC CANCER RIGEL PHARMACEUTICALS, INC. 2019-11-07 US disclosed
WO-2010005876-A2 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2010-01-14 WO disclosed
EP-2078010-A2 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2009-07-15 EP disclosed
US-20080188474-A1 e.g. 1-phenyl-N3-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-1H-1,2,4-triazole-3,5-diamine; receptor protein tyrosine kinase (AXL) antagonist; antiinflammatory, anticarcinogenic , antidiabetic agent; rheumatoid arthritis, vascular disease; breast, renal, endometrial, ovarian carcinoma, or myeloid leukemia RIGEL PHARMACEUTICALS, INC. (US) 2008-08-07 US disclosed
US-20080188455-A1 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2008-08-07 US disclosed
US-20080188455-A1 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2008-08-07 US disclosed
WO-2008083356-A1 SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2008-07-10 WO disclosed
WO-2008083367-A2 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2008-07-10 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 (5 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-20190336500-A1 AXL INHIBITORS FOR USE IN COMBINATION THERAPY FOR PREVENTING, TREATING OR MANAGING METASTATIC CANCER AXL, FLT3, MET HRH3 1905/4885ADRA2A 3246/4885CYP2D6 4599/4885
US-20170334884-A1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ AXL, TYRO3, RET HRH3 573/4885ADRA2A 895/4885CYP2D6 3983/4885
US-20080188455-A1 POLYCYCLIC HETEROARYL SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS AXL, TYRO3, ERBB3 HRH3 1145/4885ADRA2A 2771/4885CYP2D6 4308/4885
US-20210379064-A1 AXL INHIBITORS FOR USE IN COMBINATION THERAPY FOR PREVENTING, TREATING OR MANAGING METASTATIC CANCER AXL, FLT3, MET HRH3 1905/4885ADRA2A 3246/4885CYP2D6 4599/4885
US-20080188474-A1 e.g. 1-phenyl-N3-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-1H-1,2,4-triazole-3,5-diamine; receptor protein tyrosine kinase (AXL) antagonist; antiinflammatory, anticarcinogenic , antidiabetic agent; rheumatoid arthritis, vascular disease; breast, renal, endometrial, ovarian carcinoma, or myeloid leukemia AXL, TYRO3, FLT3 HRH3 1213/4885ADRA2A 1783/4885CYP2D6 3172/4885

“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.