SCHEMBL9474108

SCHEMBL9474108

C(=CC1COCCO1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
JAK2 O60674 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
KDM1A O60341 3/20 0.42
CYP2C19 P33261 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 2/20 0.39
MAOA P21397 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 2/20 0.36

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
SCHEMBL202960 0.85 MAPT (0.51) MAPTLMNAMEN1JAK2HTT
SCHEMBL7772323 0.85 MAPT (0.51) MAPTLMNAMEN1JAK2HTT
SCHEMBL14332773 0.85 MAPT (0.51) MAPTLMNAMEN1JAK2HTT
SCHEMBL15184843 0.85 MAPT (0.51) MAPTLMNAMEN1JAK2HTT
SCHEMBL28230980 0.81 TSHR (0.34) LMNAHTTRAB9AALDH1A1SMN1; SMN2
SCHEMBL29108874 0.81 MAPT (0.49) MAPTLMNAMEN1JAK2HTT
Propylene Oxide SCHEMBL4759672 0.78 MAPT (0.46) MAPTLMNAMEN1JAK2HTT
SCHEMBL23357560 0.76 ALDH1A1 (0.47) MAPTLMNAMEN1JAK2HTT
SCHEMBL23357562 0.76 ALDH1A1 (0.47) MAPTLMNAMEN1JAK2HTT
SCHEMBL5530039 0.75 MEN1 (0.44) MAPTLMNAMEN1JAK2HTT

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-5270768-A Charging member containing reduced titanium oxide and device using same CANON KABUSHIKI KAISHA (JP) 1993-12-14 US disclosed