SCHEMBL1662382

SCHEMBL1662382

COc1ccc(Cl)cc1NC(=O)Nc1ccc(Oc2ccnc(C(N)=O)c2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 2/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 1/20 0.51
RAF1 P04049 6/20 0.51
MAPK14 Q16539 4/20 0.51
KDR P35968 3/20 0.51
KIT P10721 2/20 0.51
PDGFRA P16234 2/20 0.51
ABL1 P00519 2/20 0.51
RIPK2 O43353 1/20 0.51
ABCB11 O95342 1/20 0.51
NR3C1 P04150 1/20 0.51
RET P07949 1/20 0.51
HTR1A P08908 1/20 0.51
PDGFRB P09619 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
CHRM1 P11229 1/20 0.51
BCR P11274 1/20 0.51
FGFR1 P11362 1/20 0.51

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
SCHEMBL1660418 0.90 MAPK14 (0.54) DDR2RAF1MAPK14KDRKIT
SCHEMBL1660111 0.90 DDR2 (0.64) DDR2MEN1KMT2ARAF1MAPK14
SCHEMBL1660291 0.89 MAPK14 (0.47) DDR2RAF1MAPK14KDRKIT
SCHEMBL1660325 0.89 RAF1 (0.50) DDR2RAF1MAPK14KDRKIT
SCHEMBL1661121 0.89 RAF1 (0.61) DDR2MEN1KMT2AKDM4ERAF1
SCHEMBL1660260 0.88 MAPK14 (0.60) DDR2MEN1KMT2ARAF1MAPK14
SCHEMBL1659083 0.81 RAF1 (0.64) DDR2MEN1KMT2ARAF1MAPK14
SCHEMBL1660178 0.81 RAF1 (0.68) DDR2MEN1KMT2ARAF1MAPK14
SCHEMBL1659561 0.80 RAF1 (0.61) DDR2MEN1KMT2ARAF1MAPK14
SCHEMBL1659070 0.79 MAPK14 (0.53) DDR2RAF1MAPK14KDRKIT

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