SCHEMBL25318352

SCHEMBL25318352

CCC(C(=O)OC=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 3/20 0.49
HSD17B10 Q99714 1/20 0.49
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
TDP1 Q9NUW8 3/20 0.46
RECQL P46063 1/20 0.46
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
PKM P14618 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
SCHEMBL7713499 0.85 KDM4E (0.49) GAAKDM4ELMNAHSD17B10KMT2A
SCHEMBL7072928 0.85 KDM4E (0.49) GAAKDM4ELMNAHSD17B10KMT2A
Acetic Acid SCHEMBL27542062 0.82 KDM4E (0.47) GAAKDM4ELMNAHSD17B10KMT2A
Acetic Acid SCHEMBL27432920 0.82 KDM4E (0.47) GAAKDM4ELMNAHSD17B10KMT2A
Acetic Acid SCHEMBL27542077 0.82 KDM4E (0.47) GAAKDM4ELMNAHSD17B10KMT2A
SCHEMBL28645163 0.82 GAA (0.55) GAAKDM4ELMNAHSD17B10KMT2A
SCHEMBL2222145 0.82 GAA (0.55) GAAKDM4ELMNAHSD17B10KMT2A
SCHEMBL805646 0.80 GAA (0.62) GAAKDM4ELMNAHSD17B10KMT2A
SCHEMBL174166 0.80 KMT2A (0.60) GAAKDM4ELMNAHSD17B10KMT2A
SCHEMBL29425354 0.80 KMT2A (0.60) GAAKDM4ELMNAHSD17B10KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117624159-A Preparation method of alpha-formylphenylacetic acid isopropyl tropine ester 山东新时代药业有限公司 2024-03-01 CN disclosed
WO-2023124408-A1 CRYSTALLINE FORM OF LEUCOGEN AND METHOD FOR PREPARATION THEREOF AND USE THEREOF 江苏吉贝尔药业股份有限公司 2023-07-06 WO disclosed
CN-103596918-A Process for preparing aryl-and heteroarylacetic acid derivatives BAYER CROPSCIENCE AG 2014-02-19 CN disclosed
CN-102753513-A Process for preparing aryl and heteroaryl acetic acid derivatives BAYER CROPSCIENCE AG 2012-10-24 CN disclosed
CN-1810791-A Synthesis process of medicine for treating hemopathy ZHANG HONGYE (CN) 2006-08-02 CN disclosed