SCHEMBL16404705

SCHEMBL16404705

OSc1ccc(F)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
TERT O14746 1/20 0.37
RHEB Q15382 2/20 0.35
GRM8 O00222 2/20 0.34
GRM6 O15303 2/20 0.34
GRM2 Q14416 2/20 0.34
GRM3 Q14832 2/20 0.34
CA3 P07451 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
GRM5 P41594 1/20 0.33
NOTUM Q6P988 1/20 0.33

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
SCHEMBL4908425 0.78 DDB1 (0.39) CES2CES1DDB1CRBNTERT
SCHEMBL24952543 0.78 GRM5 (0.42) CES2CES1DDB1CRBNTERT
SCHEMBL19121400 0.74 DDB1 (0.37) CES2CES1DDB1CRBNTERT
SCHEMBL4908432 0.74 DDB1 (0.37) CES2CES1DDB1CRBNTERT
SCHEMBL4126762 0.74 DDB1 (0.37) CES2CES1DDB1CRBNTERT
SCHEMBL645965 0.74 ALDH1A1 (0.38) CES2CES1DDB1CRBNTERT
SCHEMBL19485789 0.73 ALOX15 (0.35) CA2NFE2L2
SCHEMBL28016939 0.72 NR1H2 (0.61) CES2CES1DDB1CRBNRHEB
SCHEMBL4899169 0.70 DDB1 (0.35) CES2CES1DDB1CRBNTERT
SCHEMBL1816664 0.69

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
EP-2826826-A1 Composition for forming a coating type BPSG film, substrate formed a film by said composition, and patterning process using said composition Shin-Etsu Chemical Co., Ltd. (JP) 2015-01-21 EP disclosed