SCHEMBL8854686

SCHEMBL8854686

O=[PH2]OCOS(=O)(=O)c1cc(F)ccc1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PSEN1 P49768 2/20 0.32
PSEN2 P49810 2/20 0.32
APH1B Q8WW43 2/20 0.32
NCSTN Q92542 2/20 0.32
APH1A Q96BI3 2/20 0.32
PSENEN Q9NZ42 2/20 0.32
KAT6A Q92794 1/20 0.32
PTPN1 P18031 1/20 0.32
USP2 O75604 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 2/20 0.31
LMNA P02545 1/20 0.30
NR3C2 P08235 2/20 0.30
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL8854586 0.80 IDO1 (0.37)
SCHEMBL27467358 0.78 PKM (0.37) PKMSMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL27467843 0.78 PKM (0.37) PKMSMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL8854514 0.76
SCHEMBL8854700 0.76 PKM (0.35) PKMSMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL8854528 0.76
SCHEMBL6114997 0.73 POLB (0.42) PKMKDM4EKAT6APOLBLMNA
SCHEMBL16467751 0.72 PKM (0.45) PKMSMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL8732656 0.72 PKM (0.37) PKMSMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL8854647 0.72

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
US-5693590-A PLANT GROWTH REGULATOR ROHM AND HAAS COMPANY (US) 1997-12-02 US claimed