SCHEMBL28672155

SCHEMBL28672155

CCOC(=O)CC(CC(=O)OCC)(OC(=O)c1ccccc1Cl)C(=O)OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.41
ADRB2 P07550 2/20 0.41
ADRB1 P08588 2/20 0.41
ADRB3 P13945 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.40
ACR P10323 1/20 0.39
NLRP3 Q96P20 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 1/20 0.39
HTT P42858 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
KMT2A Q03164 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 1/20 0.38
METTL3 Q86U44 1/20 0.38

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
SCHEMBL28192130 0.90 TSHR (0.54) TSHRNPSR1LMNAALDH1A1HSD17B10
SCHEMBL27662396 0.85 TSHR (0.49) TSHRNPSR1MAPTALDH1A1HSD17B10
SCHEMBL28666762 0.85 L3MBTL1 (0.49) TSHRADRB2ADRB1ADRB3LMNA
SCHEMBL28672166 0.84 TSHR (0.44) TSHRNPSR1ADRB2ADRB1ADRB3
SCHEMBL9068416 0.81 POLB (0.48) TSHRNPSR1LMNAMAPTALDH1A1
SCHEMBL28687831 0.78 TSHR (0.47) TSHRNPSR1LMNAMAPTALDH1A1
SCHEMBL28676232 0.77 LMNA (0.43) LMNAMAPTALDH1A1KMT2ARAB9A
SCHEMBL406428 0.76 TSHR (0.74) TSHRADRB2ADRB1ADRB3LMNA
SCHEMBL28687825 0.75 KMT2A (0.43) TSHRADRB2ADRB1ADRB3LMNA
SCHEMBL28665145 0.74 ALDH1A1 (0.48) TSHRNPSR1ADRB2ADRB1ADRB3

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-107417819-B Solid catalyst component for olefin polymerization, catalyst and application thereof 北京利和知信科技有限公司 2021-11-16 CN disclosed