SCHEMBL11244332

SCHEMBL11244332

CCCCCCOCC(CCl)OC(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 6/20 0.46
USP2 O75604 1/20 0.42
LPAR1 Q92633 3/20 0.42
LPAR3 Q9UBY5 3/20 0.42
HTT P42858 1/20 0.41
CES2 O00748 1/20 0.41
LPAR5 Q9H1C0 2/20 0.40
LPAR6 P43657 1/20 0.40
LPAR4 Q99677 1/20 0.40
LPAR2 Q9HBW0 1/20 0.40
TLR2 O60603 1/20 0.40
AKT1 P31749 1/20 0.40
AKT2 P31751 1/20 0.40
AKT3 Q9Y243 1/20 0.40

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
SCHEMBL10940945 0.86 USP2 (0.51) PLA2G2CUSP2LPAR1LPAR3AKT1
SCHEMBL1470040 0.81 ALDH1A1 (0.40) PLA2G2CUSP2LPAR1LPAR3
SCHEMBL10831321 0.79 EPHX1 (0.51) PLA2G2CUSP2LPAR1LPAR3HTT
SCHEMBL1469678 0.78 PLA2G2C (0.48) PLA2G2CUSP2LPAR1LPAR3HTT
SCHEMBL10941828 0.77 USP2 (0.51) PLA2G2CUSP2LPAR1LPAR3
SCHEMBL10943913 0.77 USP2 (0.56) PLA2G2CUSP2LPAR1LPAR3HTT
SCHEMBL11244338 0.76 PLA2G2C (0.42) PLA2G2CUSP2HTTCES2
SCHEMBL11294443 0.76 PLA2G2C (0.55) PLA2G2CUSP2LPAR1LPAR3HTT
SCHEMBL22272180 0.76 USP2 (0.38) PLA2G2CUSP2LPAR1LPAR3HTT
SCHEMBL1469545 0.75 NAAA (0.44) PLA2G2CCES2AKT1

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