SCHEMBL31154485

SCHEMBL31154485

Cn1cc(Cl)c(Cl)c1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.37
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.31
TTR P02766 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
BAZ2B Q9UIF8 1/20 0.31
BAZ2A Q9UIF9 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PKM P14618 1/20 0.30
DPP4 P27487 1/20 0.30
MYC P01106 1/20 0.30
NR4A1 P22736 1/20 0.30
TP53 P04637 1/20 0.30
CTSB P07858 1/20 0.30

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
SCHEMBL24017579 0.74 CA1 (0.41) CYP2C9ALDH1A1PKM
SCHEMBL27341809 0.70 DPP4 (0.39) CYP2C9MEN1POLBKMT2ATSHR
SCHEMBL28782535 0.67 GPR35 (0.37) MEN1POLBKMT2AALDH1A1TDP1
SCHEMBL16860615 0.66
SCHEMBL2976076 0.65 TP53 (0.39) CYP2C9MEN1POLBKMT2AALDH1A1
SCHEMBL11828644 0.65 GPR35 (0.40) TTR
SCHEMBL5154729 0.65 KDM4E (0.31) MEN1KMT2ATDP1KDM4E
SCHEMBL7253526 0.65 NOTUM (0.40) MEN1POLBKMT2AALDH1A1TDP1
SCHEMBL21879818 0.65 APOBEC3A (0.42) POLBTSHRALDH1A1KDM4EPKM
SCHEMBL5553127 0.65 TP53 (0.39) POLBALDH1A1TDP1KDM4ETP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118993926-A Preparation method of chiral amino acid 香港大学 2024-11-22 CN disclosed