SCHEMBL8747440

SCHEMBL8747440

CCCC(O)CC[C@H](CC)OC(=O)c1[c]cccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.40
PRKCD Q05655 2/20 0.40
KDM4E B2RXH2 1/20 0.34
CTSK P43235 4/20 0.33
CTSL P07711 2/20 0.33
CTSB P07858 2/20 0.33
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
CA2 P00918 1/20 0.32
CYP3A4 P08684 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
POLB P06746 1/20 0.31
KLK7 P49862 1/20 0.30
KLK5 Q9Y337 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
SCHEMBL8747437 1.00 PRKCA (0.40) PRKCAPRKCDKDM4ECTSKCTSL
SCHEMBL11469429 0.90 PRKCA (0.48) PRKCAPRKCDKDM4ECTSKCTSL
SCHEMBL8747427 0.87 ALDH1A1 (0.40) KDM4ECTSKCTSLCTSBALDH1A1
SCHEMBL8747429 0.87 ALDH1A1 (0.40) KDM4ECTSKCTSLCTSBALDH1A1
SCHEMBL8747246 0.84 GABRA1 (0.34) KDM4ETSHR
SCHEMBL8747453 0.82 PRKCA (0.36) PRKCAPRKCDKDM4ECTSKCTSL
SCHEMBL6953946 0.76 MAPT (0.41) KDM4EALDH1A1TSHRCYP3A4MEN1
SCHEMBL8747358 0.73 ALDH1A1 (0.35) KDM4ECTSKCTSLCTSBALDH1A1
SCHEMBL8747459 0.72 GABRA1 (0.32) ALDH1A1TSHR
SCHEMBL8747455 0.72 GABRA1 (0.32) ALDH1A1TSHR

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-0585032-B1 Anti-ferroelectric liquid crystal and liquid crystal display device MITSUBISHI GAS CHEMICAL CO (JP) 1997-03-05 EP disclosed
US-5340498-A High speed response MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-08-23 US disclosed
EP-0585032-A1 Anti-ferroelectric liquid crystal and liquid crystal display device MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-03-02 EP disclosed