SCHEMBL22650202

SCHEMBL22650202

COc1ccc(Nc2ccc(Oc3ccccc3)cc2)c(C(=O)O)c1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.73
LMNA P02545 2/20 0.73
KMT2A Q03164 2/20 0.73
POLB P06746 2/20 0.73
MAPT P10636 1/20 0.73
AKR1C3 P42330 15/20 0.66
AKR1C2 P52895 15/20 0.66
HPGD P15428 1/20 0.66
GFER P55789 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
CTSV O60911 1/20 0.60
CTSL P07711 1/20 0.60
FABP3 P05413 1/20 0.56
FABP4 P15090 1/20 0.56
KDM4E B2RXH2 1/20 0.56

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
SCHEMBL10652538 0.91 AKR1C3 (0.78) MEN1LMNAKMT2APOLBMAPT
SCHEMBL9593627 0.90 MEN1 (0.83) MEN1LMNAKMT2APOLBMAPT
SCHEMBL16742044 0.89 MEN1 (0.73) MEN1LMNAKMT2APOLBMAPT
SCHEMBL9594696 0.87 AKR1C3 (0.81) MEN1LMNAKMT2APOLBMAPT
SCHEMBL9593591 0.86 AKR1C3 (0.79) MEN1LMNAKMT2APOLBMAPT
SCHEMBL10834390 0.86 MEN1 (0.77) MEN1LMNAKMT2APOLBMAPT
SCHEMBL5676620 0.84 MEN1 (0.75) MEN1LMNAKMT2APOLBMAPT
SCHEMBL22453331 0.84 MEN1 (0.67) MEN1LMNAKMT2APOLBMAPT
SCHEMBL22720113 0.83 MEN1 (0.72) MEN1LMNAKMT2APOLBMAPT
SCHEMBL10833896 0.83 CTSV (0.69) MEN1LMNAKMT2APOLBMAPT

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-2020225330-A1 DHODH INHIBITORS AND THEIR USE AS ANTIVIRAL AGENTS UNIVERSITÄT HAMBURG (DE) 2020-11-12 WO disclosed