SCHEMBL937080

SCHEMBL937080

CN(C=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)no3)cc2Cl)ccn1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.56
RAF1 P04049 5/20 0.53
BRAF P15056 8/20 0.47
MAPK13 O15264 1/20 0.45
FLT3 P36888 2/20 0.43
ALDH1A1 P00352 1/20 0.40
ESRRA P11474 1/20 0.39
KDR P35968 2/20 0.38
CSF1R P07333 1/20 0.38

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
SCHEMBL1846389 0.88 RAF1 (0.69) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL938806 0.86 FLT3 (0.55) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL937084 0.81 MAPK14 (0.57) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL938856 0.78 RAF1 (0.56) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL1843969 0.78 RAF1 (0.67) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL1846312 0.78 MAPK14 (0.53) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL1843675 0.73 RAF1 (0.68) MAPK14RAF1MAPK13FLT3KDR
SCHEMBL938129 0.71 RAF1 (0.71) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL938073 0.71 MAPT (0.56) MAPK14RAF1BRAFMAPK13FLT3
SCHEMBL667897 0.70 RAF1 (1.00) MAPK14RAF1BRAFMAPK13FLT3

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-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
EP-2324825-A1 Aryl ureas with angiogenesis inhibiting activity Bayer Healthcare LLC (US) 2011-05-25 EP 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 MAPK14 445/4885RAF1 867/4885BRAF 487/4885
US-10653684-B2 Aryl ureas with angiogenisis inhibiting activity FLT1, FLT4, KDR MAPK14 445/4885RAF1 867/4885BRAF 487/4885
US-20110015195-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR MAPK14 445/4885RAF1 867/4885BRAF 487/4885
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity FLT1, FLT4, KDR MAPK14 445/4885RAF1 867/4885BRAF 487/4885
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY FLT4, FLT1, KDR MAPK14 380/4885RAF1 817/4885BRAF 290/4885
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR MAPK14 445/4885RAF1 867/4885BRAF 487/4885

“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.