SCHEMBL28061564

SCHEMBL28061564

FC(F)(F)Oc1c[c]ccc1CC1(COc2ccccc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.35
PPARD Q03181 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
AKT2 P31751 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TACR1 P25103 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 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
SCHEMBL28061544 0.80 LMNA (0.39)
SCHEMBL28061589 0.75 SLC6A3 (0.35)
SCHEMBL28061570 0.72 EPHX2 (0.33)
SCHEMBL28061573 0.72 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL327190 0.71 KCNA3 (0.39) MEN1KMT2A
SCHEMBL28061554 0.71 SLC6A4 (0.38) CYP1A2
SCHEMBL28128976 0.69 MEN1 (0.35) MEN1KMT2A
SCHEMBL28793420 0.67
SCHEMBL21268313 0.67 EPHX2 (0.32)
SCHEMBL3542512 0.67 EPHX2 (0.32)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105693645-B Condensed heterocyclic compouds as ion channel modulators 吉利德科学公司 2018-10-09 CN disclosed
CN-105693645-A FUSED HETEROCYCLIC COMPOUNDS AS SODIUM CHANNEL MODULATORS 吉利德科学公司 2016-06-22 CN disclosed
CN-103649056-B Fused heterocyclic compounds as modulators of ion channels GILEAD SCIENCES, INC. (US) 2016-04-27 CN disclosed