SCHEMBL28068335

SCHEMBL28068335

CCCCOC(=O)C1C=CC(C(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.43
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PPARG P37231 3/20 0.40
PPM1B O75688 1/20 0.40
PTPN1 P18031 1/20 0.40
PPP1CC P36873 1/20 0.40
HPGD P15428 3/20 0.39
ATM Q13315 2/20 0.39
HCAR2 Q8TDS4 1/20 0.39
TSHR P16473 3/20 0.38
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 2/20 0.36
ESR1 P03372 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
SCHEMBL28068408 0.94 PPARG (0.48) ALDH1A1PPARGHCAR2TSHRCHRM2
SCHEMBL28004197 0.94 PPARG (0.48) ALDH1A1PPARGHCAR2TSHRCHRM2
SCHEMBL27712510 0.94 PPARG (0.48) ALDH1A1PPARGHCAR2TSHRCHRM2
SCHEMBL27692610 0.94 PPARG (0.48) ALDH1A1PPARGHCAR2TSHRCHRM2
SCHEMBL27478992 0.90 PPM1B (0.49) ALDH1A1L3MBTL1MAPK1KDM4EPPARG
SCHEMBL28068409 0.79 PPARG (0.47) ALDH1A1MAPK1KDM4EPPARGPPM1B
SCHEMBL4859807 0.78 THRB (0.45) ALDH1A1PPM1BPTPN1PPP1CCTSHR
SCHEMBL11851502 0.78 ALDH1A1 (0.43) ALDH1A1L3MBTL1MAPK1KDM4EHPGD
SCHEMBL30901553 0.76 ALDH1A1 (0.48) ALDH1A1L3MBTL1MAPK1KDM4EPPARG
SCHEMBL14475702 0.75 ALDH1A1 (0.44) ALDH1A1L3MBTL1MAPK1KDM4EHPGD

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-105504110-A Preparation method of catalyst solid component for olefin polymerization SHENHUA GROUP CORP LTD 2016-04-20 CN disclosed