SCHEMBL28541908

SCHEMBL28541908

CC(C)c1ccc(C(=O)O[C]=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.46
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45
USP5 P45974 1/20 0.44
POLB P06746 2/20 0.44
HTT P42858 1/20 0.42
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 1/20 0.42
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RAB9A P51151 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPC1 O15118 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 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
SCHEMBL9699988 0.79 CYP2C9 (0.52) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL23404253 0.79 CYP2C9 (0.52) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL1377356 0.78 CES2 (0.50) HTTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL15846816 0.78 LMNA (0.52) CYP2C9PRSS1POLBALDH1A1MEN1
SCHEMBL84424 0.78 CA1 (0.59) CYP2C9ALDH1A1MEN1KMT2ARAB9A
SCHEMBL9350953 0.78 CYP2C9 (0.50) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL28555663 0.77 PTGS1 (0.46) CYP2C9ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL16077008 0.76 CA12 (0.68) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL7642134 0.76 CYP2C9 (0.48) CYP2C9PRSS1ACRUSP5POLB
SCHEMBL12647011 0.76 CYP2C9 (0.48) CYP2C9PRSS1ACRUSP5POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553706-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553703-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 claimed
CN-109553711-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553706-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553703-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-109553711-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed