SCHEMBL5508748

SCHEMBL5508748

O=c1cc(CF)[nH]c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.46
CA1 P00915 1/20 0.44
TYMP P19971 3/20 0.43
HSD17B10 Q99714 3/20 0.43
TSHR P16473 2/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 2/20 0.41
UNG P13051 1/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
YTHDC1 Q96MU7 1/20 0.39
YTHDF3 Q7Z739 1/20 0.39
YTHDF1 Q9BYJ9 1/20 0.39
YTHDF2 Q9Y5A9 1/20 0.39
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37

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
SCHEMBL2959182 0.76 GPR84 (0.50) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL18018476 0.76 GPR84 (0.50) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL5071203 0.76 GPR84 (0.60) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL11844328 0.76 GPR84 (0.50) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL9220998 0.76 GPR84 (0.50) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL317706 0.76 GPR84 (0.50) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL6066218 0.76 PDPK1 (0.54) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL4561073 0.76 GPR84 (0.50) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL1272345 0.73 GPR84 (0.56) GPR84SMN1; SMN2CA1TYMPHSD17B10
SCHEMBL12775736 0.73 GPR84 (0.56) GPR84SMN1; SMN2CA1TYMPHSD17B10

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