SCHEMBL28023012

SCHEMBL28023012

CC(CCOC(=O)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 1/20 0.45
NHERF1 O14745 1/20 0.43
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 2/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
CA12 O43570 1/20 0.39
MMP2 P08253 1/20 0.39
CA14 Q9ULX7 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL28023651 0.91 LMNA (0.53) NPC1RAB9ALMNATDP1ALDH1A1
SCHEMBL28023633 0.87 LMNA (0.47) NPC1RAB9ALMNATDP1ALDH1A1
SCHEMBL28023036 0.87 HPGD (0.50) HPGDNPC1RAB9ALMNATDP1
SCHEMBL28023034 0.77 HPGD (0.48) HPGDNPC1RAB9ALMNATDP1
SCHEMBL28023649 0.77 HSD11B1 (0.55) HPGDNPC1RAB9ALMNATDP1
SCHEMBL28023029 0.76 ALDH1A1 (0.56) NPC1RAB9ALMNATDP1ALDH1A1
SCHEMBL28023022 0.75 TDP1 (0.57) HPGDNPC1RAB9ALMNATDP1
SCHEMBL27286618 0.74 LMNA (0.61) NPC1RAB9ALMNATDP1ALDH1A1
SCHEMBL9939051 0.74 LMNA (0.53) NPC1RAB9ALMNATDP1ALDH1A1
SCHEMBL9939048 0.74 LMNA (0.53) NPC1RAB9ALMNATDP1ALDH1A1

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