SCHEMBL28544709

SCHEMBL28544709

CCOC(=O)C(C)(OC(=O)c1cccc(Cl)c1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 1/20 0.47
TP53 P04637 1/20 0.47
ELANE P08246 1/20 0.45
CHRM1 P11229 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM3 P20309 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
VNN1 O95497 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 1/20 0.41
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
ALDH1A1 P00352 2/20 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
SCHEMBL28537124 0.87 CYP2D6 (0.48) LMNAMAPTKMT2AL3MBTL1CYP1A2
SCHEMBL28541522 0.86 CYP1A2 (0.48) MAPTKMT2ATP53ELANECYP1A2
SCHEMBL29443099 0.77 TRPV1 (0.61) LMNAKMT2ATP53ELANECHRM1
SCHEMBL197307 0.77 TRPV1 (0.61) LMNAKMT2ATP53ELANECHRM1
SCHEMBL28676232 0.77 LMNA (0.43) LMNAMAPTKMT2ATP53ELANE
SCHEMBL28911447 0.77 SMN1; SMN2 (0.45) LMNAMAPTKMT2AL3MBTL1CYP1A2
SCHEMBL28544710 0.76 MAPT (0.42) LMNAMAPTKMT2ATP53CHRM1
Hydrochloric Acid SCHEMBL27624411 0.75 TRPV1 (0.59) LMNAKMT2ATP53ELANECHRM1
SCHEMBL28614577 0.75 LMNA (0.44) LMNAMAPTKMT2ATP53ELANE
SCHEMBL1785260 0.74 PARP1 (0.52) MAPTKMT2ACHRM1CHRM2CHRM4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553705-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed