SCHEMBL4464158

SCHEMBL4464158

COc1ccc(C(F)(F)F)cc1NC(=O)Nc1cccc(Oc2ccncc2)c1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 12/20 0.68
BRAF P15056 5/20 0.64
KDR P35968 1/20 0.64
MAPK14 Q16539 1/20 0.64
TNNI3K Q59H18 1/20 0.64
ALDH1A1 P00352 2/20 0.54
MEN1 O00255 1/20 0.54
MAPT P10636 1/20 0.54
KMT2A Q03164 1/20 0.54
P2RY1 P47900 1/20 0.54

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
SCHEMBL938321 0.90 RAF1 (0.74) RAF1BRAFKDRMAPK14TNNI3K
SCHEMBL936917 0.89 RAF1 (0.64) RAF1BRAFKDRALDH1A1MEN1
SCHEMBL1395927 0.87 RAF1 (0.68) RAF1BRAFKDRMAPK14TNNI3K
SCHEMBL938889 0.86 RAF1 (0.84) RAF1BRAFKDRMAPK14TNNI3K
SCHEMBL8370028 0.84 GRIK1 (0.65) RAF1KDRALDH1A1MEN1MAPT
SCHEMBL937860 0.83 RAF1 (0.56) RAF1BRAFKDRMAPK14TNNI3K
SCHEMBL937012 0.81 RAF1 (1.00) RAF1BRAFKDRALDH1A1
SCHEMBL938333 0.80 RAF1 (0.81) RAF1BRAFKDRMAPTP2RY1
SCHEMBL4238737 0.80 RAF1 (0.67) RAF1BRAFMAPK14ALDH1A1MEN1
SCHEMBL15574745 0.80 RAF1 (0.59) RAF1BRAFALDH1A1MAPTKMT2A

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-10653684-B2 Aryl ureas with angiogenisis inhibiting activity BAYER HEALTHCARE LLC (US) 2020-05-19 US disclosed
US-20180296541-A9 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2018-10-18 US disclosed
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2016-01-21 US disclosed
US-8618141-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE LLC (US) 2013-12-31 US disclosed
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2012-11-15 US disclosed
US-8242147-B2 Aryl ureas with angiogenisis inhibiting activity BAYER HEALTHCARE LLC (US) 2012-08-14 US disclosed
US-20090068146-A1 DIARYL UREAS AND COMBINATIONS BAYER PHARMACEUTICALS CORPORATION 2009-03-12 US disclosed
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity BAYER HEALTHCARE LLC 2008-09-18 US disclosed
US-20070020704-A1 Diaryl ureas with kinase inhibiting activity BAYER HEALTHCARE LLC 2007-01-25 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-20180296541-A9 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR RAF1 867/4885BRAF 487/4885KDR 3/4885
US-20070020704-A1 Diaryl ureas with kinase inhibiting activity FLT4, FLT1, FLT3 RAF1 51/4885BRAF 31/4885KDR 44/4885
US-10653684-B2 Aryl ureas with angiogenisis inhibiting activity FLT1, FLT4, KDR RAF1 867/4885BRAF 487/4885KDR 3/4885
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity FLT1, FLT4, KDR RAF1 867/4885BRAF 487/4885KDR 3/4885
US-20090068146-A1 DIARYL UREAS AND COMBINATIONS NR4A1, NAP1L4, NR4A3 RAF1 4118/4885BRAF 4067/4885KDR 2385/4885
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY FLT4, FLT1, KDR RAF1 817/4885BRAF 290/4885KDR 3/4885
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR RAF1 867/4885BRAF 487/4885KDR 3/4885

“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.