SCHEMBL29017995

SCHEMBL29017995

Cc1ccc(C(=O)OP(=O)(O)OC(C)(C)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
TDP1 Q9NUW8 3/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
PTK2B Q14289 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 4/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTPN5 P54829 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36

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
SCHEMBL29038810 0.86 ALDH1A1 (0.41) NPC1RAB9ATDP1POLBLMNA
SCHEMBL29017969 0.83 PLK1 (0.40) NPC1RAB9APOLBALDH1A1KMT2A
SCHEMBL29038802 0.81 TRPV1 (0.47) ALDH1A1HSD17B10
SCHEMBL29017963 0.80 TSHR (0.49) NPC1RAB9ATDP1CES1POLB
SCHEMBL6522079 0.78 TDP1 (0.57) NPC1RAB9ATDP1CES2CES1
SCHEMBL8849102 0.78 ALDH1A1 (0.54) POLBALDH1A1KMT2AALOX15TSHR
SCHEMBL29324959 0.77 NPC1 (0.49) NPC1RAB9ATDP1CES2CES1
SCHEMBL28670552 0.77 TSHR (0.43) NPC1RAB9APTK2BRXFP1LMNA
SCHEMBL29017987 0.76 ALDH1A1 (0.40) NPC1RAB9ATDP1POLBLMNA
SCHEMBL28456710 0.74 ALDH1A1 (0.48) CES1POLBLMNAALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113929797-B Solid catalyst component and catalyst system for producing polymers 中国石油化工股份有限公司 2023-07-21 CN disclosed
CN-113929799-B Catalyst component for olefin polymerization, catalyst system and use 中国石油化工股份有限公司 2023-05-09 CN disclosed
CN-114085301-B Solid catalyst component for preparing olefin polymer and application thereof 中国石油化工股份有限公司 2023-05-09 CN disclosed