SCHEMBL4202008

SCHEMBL4202008

CC(C)(C)OC(=O)c1cc(Oc2ccc(N)cc2)ccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 6/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
EPHX2 P34913 2/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
KDR P35968 6/20 0.43
PLK4 O00444 1/20 0.40
AURKA O14965 1/20 0.40
MAPK13 O15264 1/20 0.40
JAK2 O60674 1/20 0.40
MAP4K4 O95819 1/20 0.40
ABL1 P00519 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
LYN P07948 1/20 0.40
RET P07949 1/20 0.40
ROS1 P08922 1/20 0.40

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
SCHEMBL12329785 0.88 NR4A1 (0.45) RAF1EPHX2KDRPLK4AURKA
SCHEMBL2028320 0.85 MAPK14 (0.43) RAF1EPHX2KDRPLK4AURKA
SCHEMBL1642878 0.85 KDR (0.48) RAF1MAPTALDH1A1EPHX2KDR
SCHEMBL9979938 0.83 RAF1 (0.38) RAF1EPHX2KDRPLK4AURKA
SCHEMBL2892341 0.83 RAF1 (0.42) RAF1EPHX2KDRPLK4AURKA
SCHEMBL12852960 0.82 RAF1 (0.54) RAF1EPHX2MAPK1KDRPLK4
SCHEMBL6383415 0.81 KDR (0.47) RAF1MAPTALDH1A1RAB9AEPHX2
SCHEMBL22473756 0.81 CYP1A2 (0.49) RAF1MAPTALDH1A1NPC1RAB9A
SCHEMBL3882564 0.81 GABRG2 (0.45) RAF1EPHX2GABRA1GABRG2GABRB3
SCHEMBL2886711 0.81 MAPT (0.40) RAF1MAPTALDH1A1EPHX2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3409772-B1 INTRACELLULAR SUBSTANCE TRANSPORT SYSTEM AND USE THEREOF UNIV HOKKAIDO NAT UNIV CORP (JP) 2023-06-28 EP disclosed
US-11078232-B2 Preparation and use of molecular site targeted and activated kinase inhibitor Yafei Shanghai Biology Medicine Science & Technology Co. Ltd. (CN) 2021-08-03 US disclosed
US-11007276-B2 Intracellular substance transport system and use thereof NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2021-05-18 US disclosed
US-20200140485-A1 PREPARATION AND USE OF MOLECULAR SITE TARGETED AND ACTIVATED KINASE INHIBITOR Yafei Shanghai Biology Medicine Science & Technology Co. Ltd. (CN) 2020-05-07 US disclosed
US-20200138973-A1 INTRACELLULAR SUBSTANCE TRANSPORT SYSTEM AND USE THEREOF NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2020-05-07 US disclosed
EP-3330254-A2 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA Suzhou Zelgen Biopharmaceutical Co., Ltd. (CN) 2018-06-06 EP disclosed
EP-2548868-B1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA -DIPHENYLUREA SUZHOU ZELGEN BIOPHARMACEUTICAL CO LTD (CN) 2018-01-24 EP disclosed
US-9078933-B2 Deuterated omega diphenylurea related compounds and intermediates SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2015-07-14 US disclosed
US-20140128612-A1 DEUTERATED OMEGA DIPHENYLUREA RELATED COMPOUNDS AND INTERMEDIATES SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2014-05-08 US disclosed
US-8669369-B2 Method and process for preparation and production of deuterated Ω-diphenylurea SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. (CN) 2014-03-11 US disclosed
US-8486951-B2 Cyclopropane amides and analogs exhibiting anti-cancer and anti-proliferative activities DECIPHERA PHARMACEUTICALS, LLC (US) 2013-07-16 US disclosed
US-20130079362-A1 CYCLOPROPANE AMIDES AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITIES DECIPHERA PHARMACEUTICALS, LLC (US) 2013-03-28 US disclosed
US-20130035492-A1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. 2013-02-07 US disclosed
EP-2548868-A1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED -DIPHENYLUREA Suzhou Zelgen Biopharmaceutical Co., Ltd. (CN) 2013-01-23 EP disclosed
CN-102803222-A Method and process for preparation and production of deuterated omega-diphenylurea SUZHOU ZELGEN BIOPHARMACEUTICAL CO LTD 2012-11-28 CN disclosed
US-20090012091-A1 Oximide derivatives and their therapeutical application KINAGEN, INC. (US) 2009-01-08 US disclosed
US-20090012091-A1 Oximide derivatives and their therapeutical application KINAGEN, INC. (US) 2009-01-08 US disclosed
US-20090012091-A1 Oximide derivatives and their therapeutical application KINAGEN, INC. (US) 2009-01-08 US 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 (8 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-20130079362-A1 CYCLOPROPANE AMIDES AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITIES KIT, PDGFRA, PDGFRB RAF1 25/4885MAPT 3045/4885ALDH1A1 1288/4885
US-20090012091-A1 Oximide derivatives and their therapeutical application CYP11B2, NOS2, HMOX2 RAF1 3755/4885MAPT 2130/4885ALDH1A1 376/4885
US-20200138973-A1 INTRACELLULAR SUBSTANCE TRANSPORT SYSTEM AND USE THEREOF CTSS, CTSA, CTSB RAF1 615/4885MAPT 2238/4885ALDH1A1 3078/4885
US-20130035492-A1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA PNLIP, PDXK, PNP RAF1 1962/4885MAPT 4536/4885ALDH1A1 2645/4885
US-11078232-B2 Preparation and use of molecular site targeted and activated kinase inhibitor ACP1, PACSIN2, PKN2 RAF1 127/4885MAPT 2880/4885ALDH1A1 3841/4885
US-20140128612-A1 DEUTERATED OMEGA DIPHENYLUREA RELATED COMPOUNDS AND INTERMEDIATES PNLIP, PDXK, DGKK RAF1 1043/4885MAPT 4529/4885ALDH1A1 2354/4885
US-20200140485-A1 PREPARATION AND USE OF MOLECULAR SITE TARGETED AND ACTIVATED KINASE INHIBITOR ACP1, PACSIN2, PKN2 RAF1 122/4885MAPT 3081/4885ALDH1A1 3875/4885
US-11007276-B2 Intracellular substance transport system and use thereof CTSS, CTSA, CTSB RAF1 615/4885MAPT 2238/4885ALDH1A1 3078/4885

“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.