SCHEMBL4206143

SCHEMBL4206143

CC(C)(C)OC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)ccn1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 10/20 0.76
KDR P35968 7/20 0.76
EPHX2 P34913 3/20 0.76
RET P07949 3/20 0.76
BRAF P15056 3/20 0.76
GSK3B P49841 2/20 0.76
RIPK2 O43353 2/20 0.76
ABCB11 O95342 2/20 0.76
ABL1 P00519 2/20 0.76
HTR1A P08908 2/20 0.76
PDGFRB P09619 2/20 0.76
ADORA3 P0DMS8 2/20 0.76
KIT P10721 2/20 0.76
FGFR1 P11362 2/20 0.76
PDGFRA P16234 2/20 0.76
FLT1 P17948 2/20 0.76
MAOA P21397 2/20 0.76
EPHA1 P21709 2/20 0.76
TBXA2R P21731 2/20 0.76
EPHA2 P29317 2/20 0.76

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
SCHEMBL3407209 0.91 RAF1 (0.80) RAF1KDREPHX2RETBRAF
SCHEMBL14715080 0.91 RAF1 (0.79) RAF1KDREPHX2RETBRAF
SCHEMBL10000735 0.89 RAF1 (0.83) RAF1KDREPHX2RETBRAF
SCHEMBL26158852 0.89 RAF1 (0.79) RAF1KDREPHX2RETBRAF
SCHEMBL22473669 0.88 RAF1 (0.77) RAF1KDREPHX2RETBRAF
SCHEMBL24535359 0.88 RAF1 (0.84) RAF1KDREPHX2RETBRAF
SCHEMBL3408499 0.87 RAF1 (0.83) RAF1KDREPHX2RETBRAF
SCHEMBL28948534 0.87 RAF1 (0.83) RAF1KDREPHX2RETBRAF
SCHEMBL29793192 0.87 RAF1 (0.83) RAF1KDREPHX2RETBRAF
Sorafenib SCHEMBL14739751 0.87 RAF1 (1.00) RAF1KDREPHX2RETBRAF

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 12 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
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-20130035492-A1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA SUZHOU ZELGEN BIOPHARMACEUTICAL CO., LTD. 2013-02-07 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
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 (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-20090012091-A1 Oximide derivatives and their therapeutical application CYP11B2, NOS2, HMOX2 RAF1 3755/4885KDR 1151/4885EPHX2 364/4885
US-20200138973-A1 INTRACELLULAR SUBSTANCE TRANSPORT SYSTEM AND USE THEREOF CTSS, CTSA, CTSB RAF1 615/4885KDR 1262/4885EPHX2 3245/4885
US-20130035492-A1 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA PNLIP, PDXK, PNP RAF1 1962/4885KDR 3367/4885EPHX2 281/4885
US-11078232-B2 Preparation and use of molecular site targeted and activated kinase inhibitor ACP1, PACSIN2, PKN2 RAF1 127/4885KDR 1924/4885EPHX2 3917/4885
US-20140128612-A1 DEUTERATED OMEGA DIPHENYLUREA RELATED COMPOUNDS AND INTERMEDIATES PNLIP, PDXK, DGKK RAF1 1043/4885KDR 3962/4885EPHX2 755/4885
US-20200140485-A1 PREPARATION AND USE OF MOLECULAR SITE TARGETED AND ACTIVATED KINASE INHIBITOR ACP1, PACSIN2, PKN2 RAF1 122/4885KDR 1954/4885EPHX2 3843/4885
US-11007276-B2 Intracellular substance transport system and use thereof CTSS, CTSA, CTSB RAF1 615/4885KDR 1262/4885EPHX2 3245/4885

“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.