SCHEMBL5514136

SCHEMBL5514136

CNc1ccc2c(F)c(N)cc(F)c2c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC18A1 P54219 1/20 0.34
SLC18A2 Q05940 1/20 0.34
AR P10275 1/20 0.33
TERT O14746 1/20 0.31
KCNH2 Q12809 1/20 0.31
ASH1L Q9NR48 1/20 0.31
RXRA P19793 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL5514270 0.76 CA12 (0.33) SLC18A1SLC18A2AR
SCHEMBL5513073 0.75 EGFR (0.34) TERT
SCHEMBL27620147 0.75 HTR6 (0.38) SLC18A1SLC18A2TERTKCNH2RXRA
SCHEMBL5511618 0.75 MAPK14 (0.35) SLC18A1SLC18A2ARTERT
SCHEMBL5515670 0.75 ALDH1A1 (0.33)
SCHEMBL5511612 0.72 ALDH1A1 (0.50) SLC18A1SLC18A2KCNH2TDP1
SCHEMBL5508400 0.72 ESR1 (0.42) SLC18A2AR
SCHEMBL5514071 0.71 EGFR (0.34) SLC18A1SLC18A2ARKCNH2
SCHEMBL5513274 0.69 RAPGEF4 (0.35)
SCHEMBL5522910 0.66 PRKCI (0.35)

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