SCHEMBL5475672

SCHEMBL5475672

CC(C)(C)OC(=O)NC(C)(C)c1cc(N)cc(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 1/20 0.39
BRAF P15056 1/20 0.39
CACNA1H O95180 1/20 0.39
CACNA1B Q00975 1/20 0.39
CACNA1C Q13936 1/20 0.39
STS P08842 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
MAPT P10636 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
CFTR P13569 1/20 0.36
CES2 O00748 1/20 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
SCHEMBL30022841 0.88 GABRA1 (0.33) HDAC3HDAC1HDAC2HDAC6AAK1
SCHEMBL3006398 0.84 CES2 (0.42) RAF1BRAFCACNA1HCACNA1BCACNA1C
SCHEMBL20310373 0.83 MAPT (0.46) RAF1BRAFRXFP1MAPTIKBKE
SCHEMBL545623 0.81 CAMK1D (0.41) HDAC3HDAC1HDAC2HDAC6MAPT
SCHEMBL4783457 0.81 HDAC3 (0.40) HDAC3HDAC1HDAC2HDAC6MAPT
SCHEMBL687306 0.79 RXFP1 (0.48) RXFP1MAPTIKBKELMNAP2RX1
SCHEMBL3200118 0.78 GAA (0.42) RXFP1LMNAGAA
SCHEMBL10282363 0.76 EPHX2 (0.39) MAPTLMNAPOLBAPLNR
SCHEMBL17040319 0.76 APLNR (0.38) RXFP1AAK1APLNRGAA
SCHEMBL10200705 0.76 CACNA1H (0.49) CACNA1HCACNA1BCACNA1CHDAC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530193-B2 Kinase inhibitors THE UNIVERSITY OF MANCHESTER (GB) 2022-12-20 US disclosed
US-10562899-B2 Fused tricyclic urea compounds as Raf kinase and/or Raf kinase dimer inhibitors BEIGENE, LTD. (KY) 2020-02-18 US disclosed
US-20190144446-A1 FUSED TRICYCLIC UREA COMPOUNDS AS RAF KINASE AND/OR RAF KINASE DIMER INHIBITORS BEONE MEDICINES I GMBH (CH) 2019-05-16 US disclosed
US-10208038-B2 Fused tricyclic urea compounds as Raf kinase and/or Raf kinase dimer inhibitors BEIGENE, LTD. (KY) 2019-02-19 US disclosed
EP-3013798-B1 FUSED TRICYCLIC UREA COMPOUNDS AS RAF KINASE AND/OR RAF KINASE DIMER INHIBITORS BEIGENE LTD (KY) 2018-06-27 EP disclosed
US-9920055-B2 Fused tricyclic urea compounds as raf kinase and/or raf kinase dimer inhibitors BEIGENE, LTD. (KY) 2018-03-20 US disclosed
US-20170233391-A1 FUSED TRICYCLIC UREA COMPOUNDS AS RAF KINASE AND/OR RAF KINASE DIMER INHIBITORS BEONE MEDICINES I GMBH (CH) 2017-08-17 US disclosed
US-9670203-B2 Fused tricyclic urea compounds as Raf kinase and/or Raf kinase dimer inhibitors BEIGENE, LTD. (KY) 2017-06-06 US disclosed
US-20160368914-A1 FUSED TRICYCLIC UREA COMPOUNDS AS RAF KINASE AND/OR RAF KINASE DIMER INHIBITORS BEONE MEDICINES I GMBH (CH) 2016-12-22 US disclosed
US-8110687-B2 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-02-07 US disclosed
US-8110687-B2 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-02-07 US disclosed
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
WO-2007067444-A1 BICYCLIC COMPOUNDS WITH KINASE INHIBITORY ACTIVITY MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-14 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-20160368914-A1 FUSED TRICYCLIC UREA COMPOUNDS AS RAF KINASE AND/OR RAF KINASE DIMER INHIBITORS BRAF, RAF1, ARAF RAF1 2/4885BRAF 1/4885CACNA1H 4628/4885
US-20190144446-A1 FUSED TRICYCLIC UREA COMPOUNDS AS RAF KINASE AND/OR RAF KINASE DIMER INHIBITORS BRAF, RAF1, ARAF RAF1 2/4885BRAF 1/4885CACNA1H 4628/4885
US-11530193-B2 Kinase inhibitors CAMKK2, CAMK1, CAMKK1 RAF1 152/4885BRAF 219/4885CACNA1H 1995/4885
US-20170233391-A1 FUSED TRICYCLIC UREA COMPOUNDS AS RAF KINASE AND/OR RAF KINASE DIMER INHIBITORS BRAF, RAF1, ARAF RAF1 2/4885BRAF 1/4885CACNA1H 4628/4885
US-10208038-B2 Fused tricyclic urea compounds as Raf kinase and/or Raf kinase dimer inhibitors BRAF, RAF1, ARAF RAF1 2/4885BRAF 1/4885CACNA1H 4628/4885
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MAP3K20, MAP3K1, MAP3K5 RAF1 198/4885BRAF 215/4885CACNA1H 4399/4885
US-10562899-B2 Fused tricyclic urea compounds as Raf kinase and/or Raf kinase dimer inhibitors BRAF, RAF1, ARAF RAF1 2/4885BRAF 1/4885CACNA1H 4628/4885

“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.