SCHEMBL27948832

SCHEMBL27948832

CC(C)(C)C(CS(=O)(=O)c1ccccc1)OC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HSD11B1 P28845 6/20 0.45
ALDH1A1 P00352 2/20 0.43
RECQL P46063 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TSHR P16473 2/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 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
SCHEMBL1786858 0.80 MEN1 (0.62) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL16048138 0.80 KMT2A (0.50) MEN1KMT2AHSD11B1ALDH1A1NPC1
SCHEMBL27948833 0.78 PSIP1 (0.49) MEN1KMT2AHSD11B1ALDH1A1NPC1
SCHEMBL28023643 0.77 HSD11B1 (0.45) MEN1KMT2AHSD11B1RECQLTSHR
SCHEMBL9929403 0.76 MEN1 (0.58) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL27503340 0.75 MEN1 (0.57) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL569453 0.75 MEN1 (0.57) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL20792094 0.74 ALDH1A1 (0.51) KMT2AHSD11B1ALDH1A1RAB9ATSHR
SCHEMBL31465102 0.74 KMT2A (0.56) MEN1KMT2AALDH1A1TSHRTP53
SCHEMBL16045662 0.72 MEN1 (0.54) MEN1KMT2AALDH1A1NPC1RAB9A

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