SCHEMBL28697487

SCHEMBL28697487

Cc1ccc(OP(=O)(O)OOC(=O)c2ccc(C(C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.41
ACR P10323 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SCN5A Q14524 1/20 0.40
SCN2A Q99250 1/20 0.40
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
NPSR1 Q6W5P4 3/20 0.39
MAPT P10636 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37

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
SCHEMBL28931874 1.00 PRSS1 (0.41) PRSS1ACRMEN1KMT2ASCN5A
SCHEMBL28673145 0.96 PRSS1 (0.44) PRSS1ACRMEN1KMT2AMAPT
SCHEMBL28678889 0.90 CYP3A4 (0.48) PRSS1ACRMEN1KMT2ACYP3A4
SCHEMBL28687011 0.89 HPGD (0.43) PRSS1ACRMEN1KMT2ATSHR
SCHEMBL28678893 0.89 CYP3A4 (0.47) PRSS1ACRMEN1KMT2ASCN5A
SCHEMBL28696136 0.88 SMN1; SMN2 (0.47) PRSS1ACRMEN1KMT2AMAPT
SCHEMBL28697485 0.88 PRSS1 (0.42) PRSS1ACRMEN1KMT2ASCN5A
SCHEMBL29017992 0.88 PRSS1 (0.42) PRSS1ACRMEN1KMT2ASCN5A
SCHEMBL29017966 0.87 MAPT (0.41) PRSS1ACRTDP1MAPTNPC1
SCHEMBL28689664 0.86 SMN1; SMN2 (0.43) PRSS1ACRTSHRNPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114085301-A Solid catalyst component for preparing olefin polymer and application thereof 中国石油化工股份有限公司 2022-02-25 CN claimed
CN-113929797-A Solid catalyst component and catalyst system for producing polymers 中国石油化工股份有限公司 2022-01-14 CN claimed
CN-113929798-A Solid catalyst component and catalyst system for olefin polymerization 中国石油化工股份有限公司 2022-01-14 CN claimed
CN-113929799-A Catalyst component for olefin polymerization, catalyst system and application 中国石油化工股份有限公司 2022-01-14 CN claimed