SCHEMBL28023652

SCHEMBL28023652

CC(C)c1ccc(S(=O)(=O)C(C)COC(=O)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
ADRB2 P07550 2/20 0.47
ADRB1 P08588 2/20 0.47
ADRB3 P13945 2/20 0.47
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
SLC1A5 Q15758 1/20 0.42
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
TSHR P16473 1/20 0.40
KMT2A Q03164 2/20 0.40
MAPK1 P28482 1/20 0.40
HIF1A Q16665 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
MEN1 O00255 1/20 0.39

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
SCHEMBL28023029 0.90 ALDH1A1 (0.56) ALDH1A1ADRB2ADRB1ADRB3RAB9A
SCHEMBL28023633 0.87 LMNA (0.47) ALDH1A1ADRB2ADRB1ADRB3RAB9A
SCHEMBL28023036 0.86 HPGD (0.50) ALDH1A1ADRB2ADRB1ADRB3RAB9A
SCHEMBL28023017 0.86 ALDH1A1 (0.46) ALDH1A1ADRB2ADRB1ADRB3RAB9A
SCHEMBL28023642 0.78 LMNA (0.49) ALDH1A1ADRB2ADRB1ADRB3RAB9A
SCHEMBL28023650 0.76 TDP1 (0.53) ALDH1A1RAB9ANPC1TDP1SMN1; SMN2
SCHEMBL28023651 0.76 LMNA (0.53) ALDH1A1ADRB2ADRB1ADRB3RAB9A
SCHEMBL27948827 0.76 ALDH1A1 (0.49) ALDH1A1ADRB2ADRB1ADRB3RAB9A
SCHEMBL21376003 0.74 KMT2A (0.69) ALDH1A1RAB9ANPC1TDP1SMN1; SMN2
SCHEMBL16044734 0.73 ALDH1A1 (0.53) ALDH1A1ADRB2ADRB1ADRB3RAB9A

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-103509135-B Olefin polymerization catalyst component, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2015-07-22 CN disclosed