SCHEMBL31505202

SCHEMBL31505202

O=C(/C=C/c1cccc(C(F)(F)F)c1)N1CCN(C(=O)/C=C/c2ccc(O)cc2O)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.57
P4HB P07237 1/20 0.54
ALDH1A1 P00352 1/20 0.53
TP53 P04637 1/20 0.53
HPGD P15428 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CCR2 P41597 1/20 0.48
MEN1 O00255 1/20 0.48
HSP90AA1 P07900 1/20 0.48
MAPT P10636 1/20 0.48
PKM P14618 1/20 0.48
KMT2A Q03164 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
S1PR1 P21453 1/20 0.46
S1PR5 Q9H228 1/20 0.46
ME2 P23368 1/20 0.46
ME1 P48163 1/20 0.46
ME3 Q16798 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MAOB P27338 1/20 0.45

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
SCHEMBL31505200 0.85 L3MBTL1 (0.60) LMNAALDH1A1TP53SMN1; SMN2MAPT
SCHEMBL31505210 0.83 GPR183 (0.48) MEN1MAPTKMT2AME2ME1
SCHEMBL31505195 0.81 GPR183 (0.60) HPGDMEN1KMT2APELI1
SCHEMBL31505198 0.81 MEN1 (0.55) LMNAP4HBMEN1HSP90AA1MAPT
SCHEMBL31505226 0.79 KMT2A (0.53) LMNAP4HBMEN1HSP90AA1MAPT
SCHEMBL16598455 0.76 TACR3 (0.64) LMNAALDH1A1TP53HPGDSMN1; SMN2
SCHEMBL16598452 0.76 TACR3 (0.64) LMNAALDH1A1TP53HPGDSMN1; SMN2
SCHEMBL6792908 0.75 LMNA (0.56) LMNAP4HBALDH1A1TP53HPGD
SCHEMBL31505218 0.75 CHRNA7 (0.61) PELI1
SCHEMBL10322050 0.75 PELI1 (0.67) ALDH1A1HPGDMEN1KMT2AMAOB

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-119874637-A Polyphenol tyrosinase inhibitor and preparation method and application thereof 杭州师范大学 2025-04-25 CN disclosed