SCHEMBL8569258

SCHEMBL8569258

CCOC(=O)c1cc(Sc2ccc(NC(=S)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)nc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.52
KDR P35968 4/20 0.52
FLT3 P36888 3/20 0.52
KIT P10721 2/20 0.52
TP53 P04637 5/20 0.49
MAPT P10636 2/20 0.49
DHODH Q02127 1/20 0.48
EGFR P00533 1/20 0.46
RXFP1 Q9HBX9 5/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL8563685 0.82 KDR (0.54) BRAFKDRFLT3KITTP53
SCHEMBL8561654 0.77 KDR (0.58) BRAFKDRFLT3KITMAPT
SCHEMBL8561985 0.74 TP53 (0.63) TP53MAPTRXFP1LMNAALDH1A1
SCHEMBL8562462 0.73 KDR (0.54) BRAFKDRFLT3KITMAPT
SCHEMBL8562560 0.72 BRAF (0.64) BRAFKDRFLT3KITMAPT
SCHEMBL8566456 0.72 KDR (0.58) BRAFKDRFLT3KITMAPT
SCHEMBL8562810 0.72 KDR (0.57) BRAFKDRFLT3KITMAPT
SCHEMBL8565704 0.72 KDR (0.58) BRAFKDRFLT3KITEGFR
SCHEMBL8564250 0.72 KDR (0.60) BRAFKDRFLT3KIT
SCHEMBL8566175 0.71 KDR (0.56) BRAFKDRFLT3KITMAPT

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
US-5814646-A TREATING THE PROGRESSION OF ALZHEIMER'S DISEASE, BRAIN DISORDERS ELI LILLY AND COMPANY (US) 1998-09-29 US disclosed
US-5624937-A TREATMENT OF ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 1997-04-29 US disclosed