SCHEMBL29137786

SCHEMBL29137786

COOP(=O)(O)OOc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.45
ACP3 P15309 3/20 0.43
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA4 P22748 2/20 0.38
TSHR P16473 1/20 0.37
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ANPEP P15144 1/20 0.36
LAP3 P28838 1/20 0.36
CA2 P00918 1/20 0.35
CA5A P35218 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
Methyl Alcohol SCHEMBL29038483 0.90 SRC (0.50) SRCACP3CYP2C9CYP2C19CA4
SCHEMBL3490037 0.90 SRC (0.54) SRCACP3CYP2C9CYP2C19CA4
Hydrochloric Acid SCHEMBL3065842 0.88 SRC (0.52) SRCACP3CYP2C9CYP2C19CA4
SCHEMBL1128545 0.82 SRC (0.57) SRCCYP2C9CYP2C19POLBALDH1A1
SCHEMBL29128784 0.80 L3MBTL1 (0.42) SRCACP3CYP2C9CYP2C19TSHR
SCHEMBL28441444 0.80 SRC (0.59) SRCCYP2C9CYP2C19TSHRPOLB
SCHEMBL14860950 0.78 SRC (0.47) SRCACP3CYP2C9CYP2C19CA4
SCHEMBL11779741 0.78 KMT2A (0.41) SRCCYP2C9CYP2C19TSHRALDH1A1
SCHEMBL3401427 0.77 SRC (0.60) SRCACP3CYP2C9CYP2C19CA4
SCHEMBL29493081 0.76 L3MBTL1 (0.39) SRCCYP2C9CYP2C19TSHRL3MBTL1

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-117384695-A Lubricating oil composition for gasoline engine 中国石油化工股份有限公司 2024-01-12 CN claimed
CN-117384696-A Methanol fuel engine lubricating oil composition 中国石油化工股份有限公司 2024-01-12 CN claimed
CN-117384695-A Lubricating oil composition for gasoline engine 中国石油化工股份有限公司 2024-01-12 CN disclosed
CN-117384696-A Methanol fuel engine lubricating oil composition 中国石油化工股份有限公司 2024-01-12 CN disclosed