SCHEMBL25526322

SCHEMBL25526322

O=C(O)/C(NOC(=O)c1ccccc1)=C1/c2cc(F)c(F)cc2OCC12CC2

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GRM5 P41594 1/20 0.32
S1PR5 Q9H228 2/20 0.31
MAPK14 Q16539 3/20 0.31
PLA2G7 Q13093 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL4907232 0.60 ALDH1A1 (0.76) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL27509048 0.59 KMT2A (0.68) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL28170367 0.57 KMT2A (0.59) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL5809526 0.57 ALDH1A1 (1.00) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL29102460 0.57 ALDH1A1 (0.70) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL6269137 0.57 ALDH1A1 (0.70) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL27802385 0.56 ALDH1A1 (0.73) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL27624924 0.56 KMT2A (0.79) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL8608855 0.56 ALDH1A1 (0.49) MAPTKMT2AALDH1A1POLBMEN1
SCHEMBL158309 0.56 KMT2A (0.68) MAPTKMT2AALDH1A1POLBMEN1

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-4183783-A1 IMMUNOMODULATOR Hitgen Inc. (CN) 2023-05-24 EP disclosed