SCHEMBL28237201

SCHEMBL28237201

CCC(C)CC.CCCOC(=O)CC(=O)OCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
FAAH O00519 2/20 0.39
NAAA Q02083 1/20 0.38
DGKA P23743 1/20 0.38
ALDH1A1 P00352 5/20 0.37
HCAR2 Q8TDS4 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ESR1 P03372 1/20 0.33
CHRM1 P11229 1/20 0.33
TSHR P16473 1/20 0.33
SLC6A2 P23975 1/20 0.33
KDR P35968 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
SCHEMBL28236003 0.89 MGAM (0.48) MGAMGAASIMGAM2FAAH
SCHEMBL28237121 0.86 MGAM (0.50) MGAMGAASIMGAM2FAAH
SCHEMBL240282 0.86 MGAM (0.60) MGAMGAASIMGAM2FAAH
SCHEMBL28914455 0.84 MGAM (0.57) MGAMGAASIMGAM2FAAH
Butane SCHEMBL28237119 0.84 MGAM (0.57) MGAMGAASIMGAM2FAAH
SCHEMBL2356624 0.83 ELANE (0.39) NAAADGKAALDH1A1HCAR2SMN1; SMN2
Malonic Acid Diethyl Ester SCHEMBL28236126 0.82 GAA (0.71) MGAMGAASIMGAM2ALDH1A1
SCHEMBL12111495 0.81 LMNA (0.47) MGAMGAASIMGAM2FAAH
SCHEMBL240898 0.79 GAA (0.75) MGAMGAASIMGAM2FAAH
SCHEMBL240959 0.79 MGAM (0.52) MGAMGAASIMGAM2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108473612-A The manufacturing method of solid catalyst component for olefin polymerization, polymerization of olefines catalyst and olefin polymer 东邦钛株式会社 2018-08-31 CN disclosed