SCHEMBL24089767

SCHEMBL24089767

CN(CCO)c1ccc(-c2ccc(/C=C(\C#N)C(=O)OC(C)(C)C)o2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.53
TP53 P04637 8/20 0.53
THRB P10828 2/20 0.53
KDM4E B2RXH2 2/20 0.48
RECQL P46063 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
LMNA P02545 3/20 0.44
POLB P06746 2/20 0.44
RXFP1 Q9HBX9 1/20 0.42
TDP1 Q9NUW8 1/20 0.39
SIRT5 Q9NXA8 1/20 0.39

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
SCHEMBL24089689 0.88 MAPT (0.47) MAPTTP53THRBKDM4ERECQL
SCHEMBL21037254 0.82 MEN1 (0.45) MAPTKDM4ERECQLMEN1ALDH1A1
SCHEMBL24089680 0.80 APP (0.38) MAPTTP53THRBKDM4EMEN1
SCHEMBL24089831 0.79 LMNA (0.60) MAPTTP53THRBKDM4ERECQL
SCHEMBL21037329 0.78 MAPT (0.48) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL24089660 0.75 RPS6KA3 (0.32) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL21037409 0.74 L3MBTL1 (0.36) MAPTMEN1ALDH1A1KMT2A
SCHEMBL21037855 0.74 APP (0.35) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL24089762 0.73 ALDH1A1 (0.50) MAPTTP53KDM4ESMN1; SMN2MEN1
SCHEMBL22314205 0.73 APP (0.41) MAPTKDM4EMEN1ALDH1A1KMT2A

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
US-20210382060-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF Shanghai Glory Capital Management Ltd. (CN) 2021-12-09 US disclosed