SCHEMBL11244338

SCHEMBL11244338

CCCCCCOCCC(Cl)OC(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 6/20 0.42
CES2 O00748 2/20 0.41
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 1/20 0.40
NAAA Q02083 1/20 0.39
EPHX1 P07099 1/20 0.37
PLA2G2A P14555 1/20 0.36
TSHR P16473 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL28655911 0.78 ALDH1A1 (0.48) MAPTTSHRALDH1A1
SCHEMBL31112705 0.78 ZDHHC7 (0.42) MAPTNAAAEPHX1
SCHEMBL31112232 0.78 ZDHHC7 (0.42) MAPTNAAAEPHX1
SCHEMBL11244332 0.76 PLA2G2C (0.46) PLA2G2CCES2HTTUSP2
SCHEMBL31112280 0.76 ZDHHC7 (0.40) MAPTNAAAALDH1A1
SCHEMBL31112680 0.76 NAAA (0.48) NAAAEPHX1TSHRALDH1A1
SCHEMBL31112696 0.76 NAAA (0.48) NAAAEPHX1TSHRALDH1A1
SCHEMBL30288172 0.75 MEN1 (0.46) PLA2G2CCES2MEN1THRBHTT
SCHEMBL10940945 0.74 USP2 (0.51) PLA2G2CMAPTUSP2
SCHEMBL28609396 0.73 FAAH (0.42) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4332729-A CATALYZED CYCLIZATION THE DOW CHEMICAL COMPANY (US) 1982-06-01 US disclosed
US-4331604-A Preparation of cyclic carbonates THE DOW CHEMICAL COMPANY (US) 1982-05-25 US disclosed