SCHEMBL5264573

SCHEMBL5264573

Nc1cccc2c(-c3ccc(NC(=O)Nc4cc(C(F)(F)F)ccc4F)cc3)c[nH]c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 9/20 0.64
KDR P35968 9/20 0.60
KIT P10721 4/20 0.60
FLT3 P36888 4/20 0.60
CSF1R P07333 3/20 0.55
FLT1 P17948 3/20 0.55
ABL1 P00519 2/20 0.55
LCK P06239 2/20 0.55
FYN P06241 2/20 0.55
LYN P07948 2/20 0.55
SRC P12931 2/20 0.55
FLT4 P35916 2/20 0.55
BLK P51451 2/20 0.55
PDGFRB P09619 3/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
GSK3A P49840 2/20 0.52
GSK3B P49841 2/20 0.52

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
SCHEMBL3877955 0.81 RIPK1 (0.56) RIPK1KDRKITFLT3CSF1R
SCHEMBL4662498 0.80 KDR (0.60) RIPK1KDRKITFLT3CSF1R
SCHEMBL13979911 0.79 KDR (0.59) RIPK1KDRKITFLT3CSF1R
Hydrochloric Acid SCHEMBL4475918 0.79 KDR (0.59) RIPK1KDRKITFLT3CSF1R
SCHEMBL13632600 0.78 RIPK1 (1.00) RIPK1KDRKITFLT3CSF1R
SCHEMBL28078227 0.78 CA12 (0.60) RIPK1KDRKITFLT3CSF1R
SCHEMBL24710786 0.77 FLT1 (0.71) RIPK1KDRKITFLT3CSF1R
SCHEMBL4477408 0.76 KDR (0.61) RIPK1KDRKITFLT3CSF1R
SCHEMBL1924576 0.76 CA12 (0.55) RIPK1KDRKITFLT3CSF1R
SCHEMBL13712893 0.76 KDR (0.53) RIPK1KDRKITFLT3CSF1R

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
EP-1841762-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE Aventis Pharma S.A. (FR) 2007-10-10 EP claimed
WO-2006061493-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AVENTIS PHARMA S.A. (FR) 2006-06-15 WO claimed