SCHEMBL24906137

SCHEMBL24906137

COc1ccc2[nH]cc(C(=O)C=O)c2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.69
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
LMNA P02545 3/20 0.66
MAPT P10636 3/20 0.66
RAB9A P51151 2/20 0.66
MITF O75030 1/20 0.66
NPSR1 Q6W5P4 1/20 0.66
ALDH1A1 P00352 4/20 0.60
CYP1A2 P05177 2/20 0.60
CYP2C19 P33261 2/20 0.60
CYP2C9 P11712 1/20 0.59
CPT1A P50416 1/20 0.55
GPR84 Q9NQS5 1/20 0.55
KDM4E B2RXH2 3/20 0.55
HTR4 Q13639 2/20 0.54
TUBB1 Q9H4B7 1/20 0.53
NPC1 O15118 2/20 0.53
IMPDH2 P12268 1/20 0.53
IMPDH1 P20839 1/20 0.53

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
SCHEMBL592889 0.84 NR4A2 (0.77) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL27908679 0.84 NR4A2 (0.77) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL1558974 0.84 NR4A2 (0.71) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL2834218 0.83 NR4A2 (0.75) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL28386254 0.82 NPSR1 (0.74) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL11794897 0.82 LMNA (0.74) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL3633587 0.82 NR4A2 (0.73) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL5068806 0.82 NR4A2 (1.00) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL30844608 0.82 NR4A2 (0.50) NR4A2MEN1KMT2ALMNAMAPT
SCHEMBL24855193 0.82 NR4A2 (0.50) NR4A2MEN1KMT2ALMNAMAPT

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
EP-4122916-A1 METHOD FOR PREPARING AN ORGANIC COMPOUND GH Research Ireland Limited (IE) 2023-01-25 EP disclosed