SCHEMBL7609261

SCHEMBL7609261

CC(=O)Oc1ccc(C(=O)C(C)CCOC(C)C)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.40
TMPRSS15 P98073 2/20 0.40
MAOB P27338 4/20 0.40
KDM4E B2RXH2 2/20 0.40
MAOA P21397 1/20 0.38
CPS1 P31327 3/20 0.38
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL7609263 1.00 PRSS1 (0.40) PRSS1TMPRSS15MAOBKDM4EMAOA
SCHEMBL7604332 0.82 CA12 (0.40) MAOBMAOAMAPTMAPK1ALDH1A1
SCHEMBL7604329 0.82 CA12 (0.40) MAOBMAOAMAPTMAPK1ALDH1A1
SCHEMBL8040799 0.77 RARB (0.46) PRSS1MAPT
SCHEMBL8040797 0.77 RARB (0.46) PRSS1MAPT
SCHEMBL6933181 0.74 GABRA1 (0.42) PRSS1TMPRSS15MAOBKDM4EMAOA
SCHEMBL311973 0.72 KDM4E (0.67) MAOBKDM4EMAOAMAPTMAPK1
SCHEMBL7789225 0.71 PRSS1 (0.41) PRSS1TMPRSS15MAOBKDM4EMAOA
SCHEMBL7608743 0.71 PRSS1 (0.41) PRSS1TMPRSS15MAOBKDM4EMAOA
SCHEMBL7608739 0.71 PRSS1 (0.41) PRSS1TMPRSS15MAOBKDM4EMAOA

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
EP-0994098-B1 Ferrielectric liquid crystal compound MITSUBISHI GAS CHEMICAL CO (JP) 2002-11-06 EP disclosed
US-6197216-B1 BROAD TEMPERATURE RANGE; HIGH-SPEED OPTICAL RESPONSE IN SPITE OF A SMALL SPONTANEOUS POLARIZATION; USE IN AN ACTIVE MATRIX-TYPE LIQUID CRYSTAL DISPLAY DEVICE IN WHICH A LIQUID CRYSTAL IS DRIVEN FOR EACH PIXEL INDEPENDENTLY MITSUBISHI GAS CHEMICAL CO INC (JP) 2001-03-06 US disclosed
EP-0994098-A1 Ferrielectric liquid crystal compound MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2000-04-19 EP disclosed