SCHEMBL938819

SCHEMBL938819

COc1ccc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.70
CDK8 P49336 3/20 0.69
RAF1 P04049 10/20 0.68
BRAF P15056 2/20 0.66
CA7 P43166 2/20 0.66
CA9 Q16790 2/20 0.66
MEN1 O00255 1/20 0.66
PLK4 O00444 1/20 0.66
CIT O14578 1/20 0.66
AURKA O14965 1/20 0.66
MUSK O15146 1/20 0.66
EPHB6 O15197 1/20 0.66
MAPK13 O15264 1/20 0.66
MLNR O43193 1/20 0.66
MAP3K7 O43318 1/20 0.66
RIPK2 O43353 1/20 0.66
DYRK3 O43781 1/20 0.66
PDE6D O43924 1/20 0.66
NR1I2 O75469 1/20 0.66
STK10 O94804 1/20 0.66

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
SCHEMBL12319881 0.96 KDR (0.76) KDRCDK8RAF1BRAFCA7
SCHEMBL16621285 0.90 RAF1 (0.69) KDRCDK8RAF1BRAFCA7
SCHEMBL13556629 0.89 RAF1 (0.72) KDRCDK8RAF1BRAFCA7
SCHEMBL13432444 0.88 KDR (0.64) KDRCDK8RAF1BRAFCA7
SCHEMBL16628140 0.88 KDR (0.70) KDRCDK8RAF1BRAFCA7
SCHEMBL5899269 0.87 CDK8 (0.74) KDRCDK8RAF1BRAFCA7
SCHEMBL16621058 0.86 KDR (0.68) KDRCDK8RAF1BRAFCA7
SCHEMBL936533 0.86 RAF1 (0.73) KDRCDK8RAF1BRAFCA7
SCHEMBL31504026 0.86 KDR (0.68) KDRCDK8RAF1BRAFCA7
SCHEMBL30462521 0.86 RAF1 (0.73) KDRCDK8RAF1BRAFCA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2324825-A1 Aryl ureas with angiogenesis inhibiting activity Bayer Healthcare LLC (US) 2011-05-25 EP claimed
US-7838541-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE, LLC (US) 2010-11-23 US claimed
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-20110015195-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY DUMAS JACQUES 2011-01-20 US disclosed
US-7838541-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE, LLC (US) 2010-11-23 US disclosed
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity BAYER HEALTHCARE LLC 2008-09-18 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 (6 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 KDR 3/4885CDK8 125/4885RAF1 867/4885
US-10653684-B2 Aryl ureas with angiogenisis inhibiting activity FLT1, FLT4, KDR KDR 3/4885CDK8 125/4885RAF1 867/4885
US-20110015195-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR KDR 3/4885CDK8 125/4885RAF1 867/4885
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity FLT1, FLT4, KDR KDR 3/4885CDK8 125/4885RAF1 867/4885
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY FLT4, FLT1, KDR KDR 3/4885CDK8 202/4885RAF1 817/4885
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR KDR 3/4885CDK8 125/4885RAF1 867/4885

“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.