SCHEMBL30733380

SCHEMBL30733380

C=CCc1ccc(-c2ccccc2C(=O)O)c(C(=O)O)c1CC=C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.47
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX12 P18054 1/20 0.39
PTPN11 Q06124 1/20 0.39
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 3/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
MYC P01106 1/20 0.36
POLB P06746 2/20 0.36
ALOX15 P16050 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 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
SCHEMBL29182577 1.00 FOLH1 (0.47) FOLH1CYP3A4CYP2C9ALOX12PTPN11
SCHEMBL30305035 0.89 CYP3A4 (0.55) FOLH1CYP3A4CYP2C9ALOX12PTPN11
SCHEMBL28860555 0.85 FOLH1 (0.49) FOLH1CYP3A4CYP2C9ALOX12GABRA1
Phthalic Acid SCHEMBL25209633 0.85 ALDH1A1 (0.42) FOLH1CYP3A4ALDH1A1POLBALOX15
Phthalic Acid SCHEMBL28467885 0.85 ALDH1A1 (0.42) FOLH1CYP3A4ALDH1A1POLBALOX15
Phthalic Acid SCHEMBL27575179 0.85 ALDH1A1 (0.42) FOLH1CYP3A4ALDH1A1POLBALOX15
SCHEMBL28981705 0.84 FOLH1 (0.61) FOLH1CYP3A4CYP2C9ALOX12GABRA1
Phthalic Acid SCHEMBL31412848 0.82 ALDH1A1 (0.39) FOLH1CYP3A4CYP2C9ALDH1A1GAA
SCHEMBL8653759 0.82 FOLH1 (0.50) FOLH1CYP3A4CYP2C9ALOX12PTPN11
SCHEMBL18915 0.82 GAA (0.38) FOLH1GABRA1GABRB2ALDH1A1GAA

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-117377735-A Photocurable adhesive and use thereof 日东电工株式会社 2024-01-09 CN disclosed