SCHEMBL3182877

SCHEMBL3182877

CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H]1CC[C@H](OCc2c(F)cccc2F)CC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 8/20 0.64
▸ DRD2 P14416 1/20 0.42
▸ ADRA1D P25100 1/20 0.42
▸ ADRA1A P35348 1/20 0.42
▸ ADRA1B P35368 1/20 0.42
▸ HTR1A P08908 1/20 0.41
▸ HTR7 P34969 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ NMBR P28336 1/20 0.40
▸ EPHX1 P07099 1/20 0.39
▸ GSTO1 P78417 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL3182885 1.00 EPHX2 (0.64) EPHX2DRD2ADRA1DADRA1AADRA1B
SCHEMBL3183706 0.88 EPHX2 (0.66) EPHX2DRD2ADRA1DADRA1AADRA1B
SCHEMBL3183713 0.88 EPHX2 (0.66) EPHX2DRD2ADRA1DADRA1AADRA1B
SCHEMBL3194063 0.86 EPHX2 (0.62) EPHX2DRD2ADRA1DADRA1AADRA1B
SCHEMBL3194066 0.86 EPHX2 (0.62) EPHX2DRD2ADRA1DADRA1AADRA1B
SCHEMBL3178508 0.84 EPHX2 (0.62) EPHX2DRD2ADRA1DADRA1AADRA1B
SCHEMBL3178515 0.84 EPHX2 (0.62) EPHX2DRD2ADRA1DADRA1AADRA1B
SCHEMBL3178470 0.81 EPHX2 (0.72) EPHX2DRD2MEN1KMT2AEPHX1
SCHEMBL3178421 0.81 EPHX2 (0.63) EPHX2MEN1KMT2ATDP1KDM4E
SCHEMBL3178546 0.81 EPHX2 (0.63) EPHX2DRD2KMT2ATDP1KDM4E

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-7662910-B2 Inhibitors for the soluble epoxide hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-02-16 — — US claimed
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