SCHEMBL5592676

SCHEMBL5592676

O=C(Nc1ccc(F)c(C(F)(F)F)c1)Nc1cccc2c1ccn2Cc1ccncc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 4/20 0.52
BLM P54132 1/20 0.49
WRN Q14191 1/20 0.49
BRAF P15056 2/20 0.46
TRPV1 Q8NER1 7/20 0.46
RIPK1 Q13546 1/20 0.44
GRM4 Q14833 1/20 0.44
KDR P35968 2/20 0.43
TEK Q02763 1/20 0.43
NAMPT P43490 1/20 0.43
IDH2 P48735 1/20 0.42
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
FLT3 P36888 1/20 0.42
FRK P42685 1/20 0.42
CAMK2B Q13554 1/20 0.42
CAMK2D Q13557 1/20 0.42

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
SCHEMBL5592578 0.91 TRPV1 (0.57) EPHB4BLMBRAFTRPV1KDR
SCHEMBL5592683 0.90 EPHB4 (0.53) EPHB4BRAFTRPV1KDRNAMPT
SCHEMBL5592847 0.88 MEN1 (0.56) TRPV1KDRNAMPT
SCHEMBL5671277 0.88 EPHB4 (0.49) EPHB4BRAFTRPV1KDRTEK
SCHEMBL5586067 0.87 NAMPT (0.44) EPHB4TRPV1KDRTEKNAMPT
SCHEMBL5612143 0.85 EPHB4 (0.52) EPHB4BRAFTRPV1RIPK1KDR
SCHEMBL5592636 0.83 TRPV1 (0.42) EPHB4BRAFTRPV1KDRFLT1
SCHEMBL5959865 0.81 EPHB4 (0.44) EPHB4BRAFTRPV1KDRNAMPT
SCHEMBL5592573 0.80 MEN1 (0.49) EPHB4TRPV1
SCHEMBL5592888 0.80 EPHB4 (0.54) EPHB4TRPV1KDRTEK

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-1858879-B1 1,3-DIARYL SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY GILEAD CONNECTICUT INC (US) 2012-06-06 EP claimed
CN-102267978-A 1,3-diaryl substituted ureas as modulators of kinase activity 2011-12-07 CN claimed
CN-101163691-A 1, 3-diaryl substituted ureas as modulators of kinase activity CGI PHARMACEUTICALS INC (US) 2008-04-16 CN claimed
US-20060199846-A1 Certain substituted ureas as modulators of kinase activity GILEAD CONNECTICUT, INC. 2006-09-07 US claimed
EP-1858879-B1 1,3-DIARYL SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY GILEAD CONNECTICUT INC (US) 2012-06-06 EP disclosed
EP-2397478-A1 1,3-diaryl substituted ureas as modulators of kinase activity. CGI Pharmaceuticals, Inc. (US) 2011-12-21 EP disclosed
EP-2397478-A1 1,3-diaryl substituted ureas as modulators of kinase activity. CGI Pharmaceuticals, Inc. (US) 2011-12-21 EP disclosed
CN-102267978-A 1,3-diaryl substituted ureas as modulators of kinase activity 2011-12-07 CN disclosed
CN-101163691-A 1, 3-diaryl substituted ureas as modulators of kinase activity CGI PHARMACEUTICALS INC (US) 2008-04-16 CN disclosed
EP-1858879-A1 1,3-DIARYL SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY CGI Pharmaceuticals, Inc. (US) 2007-11-28 EP disclosed
US-20060199846-A1 Certain substituted ureas as modulators of kinase activity GILEAD CONNECTICUT, INC. 2006-09-07 US disclosed
WO-2006076593-A1 1,3-DIARYL SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY CGI PHARMACEUTICALS, INC. (US) 2006-07-20 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 (1 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-20060199846-A1 Certain substituted ureas as modulators of kinase activity UCK2, CHUK, AXL EPHB4 3357/4885BLM 4659/4885WRN 3824/4885

“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.