SCHEMBL28023649

SCHEMBL28023649

O=C(OCCS(=O)(=O)c1ccc(Br)cc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.55
HPGD P15428 2/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
TDP1 Q9NUW8 2/20 0.51
LMNA P02545 2/20 0.49
GRK2 P25098 3/20 0.48
RECQL P46063 2/20 0.48
MAPK1 P28482 1/20 0.48
POLB P06746 5/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
PSMD14 O00487 1/20 0.46
MMP2 P08253 1/20 0.46
DNMT1 P26358 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TSHR P16473 1/20 0.45
NHERF1 O14745 1/20 0.45

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
SCHEMBL28023022 0.92 TDP1 (0.57) HSD11B1HPGDNPC1RAB9ATDP1
SCHEMBL14336043 0.89 TDP1 (0.59) HSD11B1TDP1LMNAMAPK1POLB
SCHEMBL9723980 0.85 NPC1 (0.56) HSD11B1NPC1RAB9ATDP1LMNA
SCHEMBL28023642 0.82 LMNA (0.49) HSD11B1NPC1RAB9ATDP1LMNA
SCHEMBL27933090 0.80 TDP1 (0.66) HSD11B1TDP1LMNAMAPK1POLB
SCHEMBL27785317 0.77 TDP1 (0.66) NPC1RAB9ATDP1LMNAMAPK1
SCHEMBL14578755 0.77 KMT2A (0.57) HPGDLMNAKMT2AALDH1A1MAPT
SCHEMBL27933192 0.77 HSD11B1 (0.88) HSD11B1GRK2RECQLPOLBCTDSP1
SCHEMBL28023012 0.77 HPGD (0.48) HPGDNPC1RAB9ATDP1LMNA
SCHEMBL18775896 0.76 HPGD (0.49) HPGDNPC1RAB9ATDP1LMNA

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