SCHEMBL28548560

SCHEMBL28548560

CCCCCOC(=O)C(OC(=O)c1ccc(C)cc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.54
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 3/20 0.49
TSHR P16473 3/20 0.47
MAPK1 P28482 2/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPT P10636 3/20 0.46
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
CNR2 P34972 1/20 0.43
RECQL P46063 1/20 0.43
ESR1 P03372 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL28551391 0.96 NPSR1 (0.58) NPSR1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL28279357 0.92 NPC1 (0.53) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL28554575 0.91 NPSR1 (0.57) NPSR1NPC1RAB9ALMNATSHR
SCHEMBL28551059 0.90 ALDH1A1 (0.53) NPSR1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL28548555 0.89 NPC1 (0.48) NPSR1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL28278037 0.88 NPC1 (0.53) NPSR1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL28551050 0.88 NPC1 (0.47) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL28279359 0.88 NPC1 (0.47) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL28554572 0.87 NPSR1 (0.61) NPSR1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL28549109 0.86 ALDH1A1 (0.54) NPSR1NPC1RAB9ASMN1; SMN2LMNA

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-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 claimed
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 claimed
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