SCHEMBL27948846

SCHEMBL27948846

CCC(=O)OC(C)S(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
LMNA P02545 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HSD11B1 P28845 2/20 0.46
ATM Q13315 1/20 0.44
PSIP1 O75475 1/20 0.42
MMP1 P03956 3/20 0.41
MMP7 P09237 3/20 0.41
MMP12 P39900 3/20 0.41
MMP13 P45452 3/20 0.41
ACE P12821 2/20 0.41
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 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
SCHEMBL27698103 0.86 TSHR (0.56) TSHRLMNAHSD17B10ATMRAB9A
SCHEMBL28635736 0.84 TSHR (0.47) TSHRLMNAHSD17B10HSD11B1ATM
SCHEMBL9045030 0.83 LMNA (0.48) TSHRLMNAHSD17B10HSD11B1ATM
SCHEMBL9808496 0.82 TSHR (0.46) TSHRLMNAHSD17B10ATMMMP1
SCHEMBL787248 0.81 TSHR (0.44) TSHRLMNAHSD17B10ATMMMP1
SCHEMBL28023655 0.79 TSHR (0.50) TSHRLMNAHSD17B10HSD11B1RAB9A
SCHEMBL3182768 0.77 LMNA (0.42) TSHRLMNAHSD17B10ATMRAB9A
SCHEMBL5872395 0.77 LMNA (0.45) TSHRLMNAHSD17B10ATMRAB9A
SCHEMBL4751896 0.76 CHRM2 (0.48) TSHRLMNAHSD17B10ALDH1A1KMT2A
SCHEMBL28089748 0.75 HSD11B1 (0.49) TSHRLMNAHSD17B10HSD11B1ATM

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-A Olefin polymerization catalyst component, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2014-01-15 CN disclosed