SCHEMBL7766592

SCHEMBL7766592

CCC(CC)OC(=O)c1ccc(OC(C)=O)cc1F

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
PRSS1 P07477 1/20 0.41
TMPRSS15 P98073 1/20 0.41
MAOB P27338 4/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 1/20 0.39
MAOA P21397 1/20 0.39
ELANE P08246 1/20 0.37
CPS1 P31327 1/20 0.37
LMNA P02545 2/20 0.37
CYP3A4 P08684 1/20 0.36
PTGS2 P35354 1/20 0.36
RARA P10276 1/20 0.36
RARB P10826 1/20 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
SCHEMBL7789225 0.83 PRSS1 (0.41) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL7755287 0.82 PRSS1 (0.39) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL7755291 0.82 PRSS1 (0.39) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL6937258 0.82 PRSS1 (0.42) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL6937264 0.82 PRSS1 (0.42) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL7945142 0.81 ALDH1A1 (0.44) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL7608739 0.80 PRSS1 (0.41) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL7608743 0.80 PRSS1 (0.41) KDM4EPRSS1TMPRSS15MAOBMAPT
SCHEMBL7760866 0.80 CA12 (0.47) MAPK1LMNA
SCHEMBL7778505 0.79 ALDH1A1 (0.53) KDM4EPRSS1TMPRSS15MAPTRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10087571-A None JP disclosed
EP-0885876-B1 Swallow-tail-shaped liquid crystal compound MITSUBISHI GAS CHEMICAL CO (JP) 2001-09-05 EP disclosed
EP-0829468-B1 Swallow-tailed compound and ferrielectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL CO (JP) 2001-06-13 EP disclosed
US-5976409-A ACHIRAL ANTI-FERROELECTRIC LIQUID CRYSTAL AND CAN BE CONVERTED TO AN OPTICALLY ACTIVE ANTI-FERROELECTRIC LIQUID CRYSTAL BY MIXING IT WITH AN OPTICALLY ACTIVE COMPOUND AS A CHIRAL DOPANT. MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1999-11-02 US disclosed
US-5938973-A MIXTURE OF 4-ALKYLCARBONYLOXYBENZOIC ACID ESTER AND 4-ALKYLOXY-4*-BIPHENYLCARBOXYLIC ESTER DERIVATIVES MITSUBISHI GAS CHEMICAL COMPANY (JP) 1999-08-17 US disclosed
EP-0885876-A1 Swallow-tail-shaped liquid crystal compound MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1998-12-23 EP disclosed
JP-H1087571-A SWALLOWTAIL TYPE COMPOUND AND FERRIDIELECTRIC LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME MITSUBISHI GAS CHEM CO INC 1998-04-07 JP disclosed
EP-0829468-A1 Swallow-tailed compound and ferrielectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1998-03-18 EP disclosed