SCHEMBL8875786

SCHEMBL8875786

NC(=S)N(c1ccc(SNc2ccc(-c3ccccc3)nc2)cc1)c1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.36
KDR P35968 7/20 0.34
FLT3 P36888 4/20 0.34
PDGFRB P09619 1/20 0.34
BRAF P15056 6/20 0.34
KIT P10721 2/20 0.34
MAPT P10636 1/20 0.33
EGFR P00533 1/20 0.33
CDK8 P49336 2/20 0.32
DHODH Q02127 1/20 0.32
TP53 P04637 1/20 0.32
WNT3A P56704 1/20 0.32
EIF2AK2 P19525 1/20 0.32
LMNA P02545 1/20 0.31
FAAH O00519 1/20 0.31
GSK3B P49841 1/20 0.31
CCNC P24863 1/20 0.31

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
SCHEMBL8562815 0.83 KDR (0.49) GRM4KDRFLT3PDGFRBBRAF
SCHEMBL8875783 0.78 ALDH1A1 (0.36) GRM4KDRFLT3PDGFRBBRAF
SCHEMBL5523848 0.66 RAF1 (0.52) KDRFLT3PDGFRBBRAFMAPT
SCHEMBL28217604 0.65 GRM4 (0.44) GRM4KDRMAPTTP53LMNA
SCHEMBL8567080 0.64 PTPN2 (0.40) WNT3A
SCHEMBL22476041 0.63 GSK3B (0.52) BRAFGSK3B
SCHEMBL8562810 0.63 KDR (0.57) GRM4KDRFLT3PDGFRBBRAF
SCHEMBL58712 0.62 GRM4 (0.46) GRM4KDRMAPTTP53LMNA
SCHEMBL4246399 0.60 HTR3E (0.49) GRM4KDRLMNA
SCHEMBL30019653 0.59 HTR3E (0.44) GRM4KDRMAPTTP53LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5624937-A TREATMENT OF ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 1997-04-29 US disclosed