SCHEMBL5510148

SCHEMBL5510148

CNc1ccc(F)c2c(O)c(F)c(F)cc12

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.38
RET P07949 1/20 0.34
KIF5B P33176 1/20 0.34
KDR P35968 1/20 0.34
RAF1 P04049 2/20 0.31
BRAF P15056 2/20 0.31
APP P05067 2/20 0.31
TDO2 P48775 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL5520161 0.81 MEN1 (0.32) IDO1
SCHEMBL5512543 0.80 IDO1 (0.41) IDO1RETKIF5BKDRAPP
SCHEMBL5516157 0.80 RET (0.30) RETKIF5BKDR
SCHEMBL5511753 0.76 IDO1 (0.42) IDO1
SCHEMBL5512080 0.76 IDO1 (0.42) IDO1APPKDM4EALDH1A1GLA
SCHEMBL5507421 0.76 CA3 (0.37) IDO1KDRAPPKDM4E
SCHEMBL5515669 0.73 IDO1 (0.33) IDO1ALDH1A1
SCHEMBL5509893 0.73 HSD17B1 (0.35) IDO1ALDH1A1
SCHEMBL22487793 0.71 RET (0.39) IDO1RETKIF5BKDRRAF1
SCHEMBL5520165 0.70

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-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 US disclosed