SCHEMBL28023655

SCHEMBL28023655

CC(OC(=O)c1ccccc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
TP53 P04637 1/20 0.50
PDCD1 Q15116 1/20 0.49
CD274 Q9NZQ7 1/20 0.49
RAB9A P51151 5/20 0.46
LMNA P02545 4/20 0.46
NPC1 O15118 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 2/20 0.46
KMT2A Q03164 1/20 0.44
F2 P00734 1/20 0.44
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
POLB P06746 1/20 0.41
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41

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
SCHEMBL28635736 0.84 TSHR (0.47) TSHRRAB9ALMNANPC1SMN1; SMN2
SCHEMBL9808496 0.82 TSHR (0.46) TSHRRAB9ALMNANPC1SMN1; SMN2
SCHEMBL27698103 0.82 TSHR (0.56) TSHRRAB9ALMNANPC1SMN1; SMN2
SCHEMBL27256662 0.81 TSHR (0.52) TSHRTP53PDCD1CD274RAB9A
SCHEMBL787248 0.81 TSHR (0.44) TSHRRAB9ALMNANPC1SMN1; SMN2
SCHEMBL28023039 0.80 TSHR (0.47) TSHRTP53PDCD1CD274RAB9A
SCHEMBL27948846 0.79 TSHR (0.47) TSHRRAB9ALMNANPC1SMN1; SMN2
SCHEMBL28023023 0.79 TSHR (0.46) TSHRTP53PDCD1CD274RAB9A
SCHEMBL28023026 0.79 TSHR (0.44) TSHRTP53PDCD1CD274RAB9A
SCHEMBL28023628 0.78 LMNA (0.46) TSHRTP53PDCD1CD274RAB9A

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