SCHEMBL29017985

SCHEMBL29017985

CCc1ccc(C(=O)OP(=O)(O)Oc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
CYP2C19 P33261 2/20 0.49
ALDH1A1 P00352 5/20 0.46
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
RXRA P19793 2/20 0.46
RXRB P28702 2/20 0.46
LMNA P02545 1/20 0.41
PRSS1 P07477 1/20 0.40
ACR P10323 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
BLM P54132 1/20 0.39
PLK1 P53350 1/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
CYP2C9 P11712 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TP53 P04637 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
SCHEMBL29017967 0.91 ALDH1A1 (0.43) SMN1; SMN2CYP2C19ALDH1A1RAB9ANPC1
SCHEMBL29038800 0.89 PLK1 (0.43) SMN1; SMN2CYP2C19ALDH1A1RAB9ANPC1
SCHEMBL28696136 0.87 SMN1; SMN2 (0.47) SMN1; SMN2CYP2C19ALDH1A1RAB9ANPC1
SCHEMBL29017992 0.86 PRSS1 (0.42) SMN1; SMN2ALDH1A1RAB9ANPC1RXRA
SCHEMBL28697485 0.86 PRSS1 (0.42) SMN1; SMN2ALDH1A1RAB9ANPC1RXRA
SCHEMBL28672551 0.85 CYP2C19 (0.53) SMN1; SMN2CYP2C19ALDH1A1RXRARXRB
SCHEMBL29017960 0.85 MRGPRX4 (0.42) ALDH1A1RAB9ANPC1RXRARXRB
SCHEMBL29017962 0.83 MAPT (0.43) SMN1; SMN2ALDH1A1RAB9ANPC1LMNA
SCHEMBL28687560 0.79 ESR1 (0.43) SMN1; SMN2CYP2C19ALDH1A1RAB9ANPC1
SCHEMBL29018002 0.78 SMN1; SMN2 (0.53) SMN1; SMN2CYP2C19ALDH1A1RAB9ANPC1

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-113929798-B Solid catalyst component and catalyst system for olefin polymerization 中国石油化工股份有限公司 2023-07-21 CN claimed
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 claimed
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 claimed
CN-113929798-B Solid catalyst component and catalyst system for olefin polymerization 中国石油化工股份有限公司 2023-07-21 CN disclosed