SCHEMBL1660423

SCHEMBL1660423

COc1ccc(Br)cc1NC(=O)Nc1ccc(Oc2ccnc(C(N)=O)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 12/20 0.61
MEN1 O00255 3/20 0.48
MAPT P10636 3/20 0.48
KMT2A Q03164 3/20 0.48
TP53 P04637 2/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
KDR P35968 3/20 0.48
PDGFRA P16234 1/20 0.48
EPHX2 P34913 1/20 0.48
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
BRAF P15056 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45

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
SCHEMBL1658925 0.89 RAF1 (0.75) RAF1MEN1KMT2AMAPK1KDR
SCHEMBL1660325 0.89 RAF1 (0.50) RAF1MAPTGAAKDRPDGFRA
SCHEMBL1661121 0.88 RAF1 (0.61) RAF1MEN1MAPTKMT2AKDR
SCHEMBL1658903 0.88 RAF1 (0.54) RAF1MEN1KMT2AMAPK1KDR
SCHEMBL1662348 0.86 RAF1 (0.58) RAF1KDREPHX2BRAF
SCHEMBL1660163 0.86 RAF1 (0.66) RAF1MEN1MAPTKMT2AMAPK1
SCHEMBL1396099 0.86 RAF1 (0.82) RAF1KDREPHX2BRAF
SCHEMBL5569138 0.82 RAF1 (0.73) RAF1MEN1KMT2AMAPK1KDR
SCHEMBL1660161 0.79 RAF1 (0.63) RAF1MEN1KMT2AMAPK1KDR
SCHEMBL1660353 0.78 RAF1 (0.63) RAF1KDRPDGFRAEPHX2BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011046991-A2 CERTAIN SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY GILEAD CONNECTICUT, INC. (US) 2011-04-21 WO claimed
WO-2011046991-A2 CERTAIN SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY GILEAD CONNECTICUT, INC. (US) 2011-04-21 WO disclosed