SCHEMBL28804176

SCHEMBL28804176

C=C(NC(=O)Nc1ccc(O)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.58
MAOB P27338 1/20 0.58
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
CYP1A1 P04798 2/20 0.47
TSHR P16473 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PEPD P12955 1/20 0.47
CA12 O43570 1/20 0.47
BRD4 O60885 1/20 0.47
NR1I2 O75469 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
MB P02144 1/20 0.47
CA3 P07451 1/20 0.47
CYP3A4 P08684 1/20 0.47
RARG P13631 1/20 0.47
ALOX5AP P20292 1/20 0.47
CA4 P22748 1/20 0.47

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
SCHEMBL28946873 0.84 EPHX2 (0.51) MAPTALDH1A1MEN1KMT2ACA12
SCHEMBL28946861 0.84 ALDH1A1 (0.51) MAPTALDH1A1CYP3A4SMN1; SMN2NPC1
SCHEMBL5705914 0.81 MAOA (0.49) MAOAMAOBMAPTALDH1A1CYP1A1
SCHEMBL28804298 0.80 TIMP3 (0.51) MAPTALDH1A1MEN1KMT2ACA12
SCHEMBL28804346 0.80 ALDH1A1 (0.53) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL28804222 0.80 CA2 (0.42) MAOAMAOBMAPTALDH1A1TSHR
SCHEMBL28804273 0.78 KMT2A (0.67) MAPTMEN1KMT2ACA12CA1
SCHEMBL11327346 0.77 MAOA (0.82) MAOAMAOBMAPTALDH1A1CYP1A1
SCHEMBL28804283 0.77 ALDH1A1 (0.50) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL5156552 0.76 MAPT (0.47) MAOAMAOBMAPTALDH1A1CYP1A1

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-109791361-B Positive lithographic printing plate precursor, method for producing same, and method for producing lithographic printing plate 富士胶片株式会社 2022-06-03 CN disclosed