SCHEMBL28023039

SCHEMBL28023039

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

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
TP53 P04637 1/20 0.47
LMNA P02545 3/20 0.45
ALDH1A1 P00352 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
ATM Q13315 1/20 0.43
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
F2 P00734 1/20 0.41
HTT P42858 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
HSD11B1 P28845 1/20 0.40
PSIP1 O75475 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
SCHEMBL28023628 0.88 LMNA (0.46) TSHRTP53LMNAALDH1A1NPC1
SCHEMBL27933079 0.83 ITGAV (0.43) TSHRTP53LMNAALDH1A1NPC1
SCHEMBL28721407 0.82 ATM (0.43) TSHRLMNAALDH1A1NPC1RAB9A
SCHEMBL27933060 0.82 RBP4 (0.41) TSHRTP53LMNAALDH1A1NPC1
SCHEMBL28023655 0.80 TSHR (0.50) TSHRTP53LMNAALDH1A1NPC1
SCHEMBL5080061 0.78 ATM (0.41) TSHRLMNAALDH1A1NPC1RAB9A
SCHEMBL27948830 0.77 ALDH1A1 (0.53) TSHRLMNAALDH1A1NPC1RAB9A
SCHEMBL1330816 0.77 PSIP1 (0.50) TSHRALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL28023023 0.76 TSHR (0.46) TSHRTP53LMNAALDH1A1NPC1
SCHEMBL28261547 0.76 ATM (0.48) TSHRLMNAALDH1A1NPC1SMN1; SMN2

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