SCHEMBL30360968

SCHEMBL30360968

CCCCCOC(=O)c1ccc(C(=O)O)cc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.64
TP53 P04637 2/20 0.64
CYP3A4 P08684 2/20 0.64
MAPK1 P28482 2/20 0.64
ALDH1A1 P00352 4/20 0.62
LMNA P02545 1/20 0.62
TDP1 Q9NUW8 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
NPC1 O15118 1/20 0.54
MAPT P10636 1/20 0.54
RAB9A P51151 1/20 0.54
PTPN11 Q06124 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
PLA2G4B P0C869 1/20 0.51
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL9618567 1.00 TSHR (0.64) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL30134597 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL22289847 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL29410047 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL25307011 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL25219274 0.98 TSHR (0.62) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL1977559 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL1684001 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL29360561 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL28917304 0.98 TSHR (0.65) TSHRTP53CYP3A4MAPK1ALDH1A1

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
WO-2023088407-A1 METHOD FOR PREPARING REVERSE OSMOSIS MEMBRANE FOR SEAWATER DESALINATION AND REVERSE OSMOSIS MEMBRANE PREPARED THEREFROM 沃顿科技股份有限公司 2023-05-25 WO disclosed