SCHEMBL3720530

SCHEMBL3720530

Fc1ccc(NCc2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.76
KMT2A Q03164 6/20 0.76
MAPT P10636 5/20 0.76
BLM P54132 3/20 0.76
GAA P10253 2/20 0.76
TP53 P04637 1/20 0.76
ATM Q13315 1/20 0.76
F2 P00734 1/20 0.69
ALDH1A1 P00352 4/20 0.65
L3MBTL1 Q9Y468 3/20 0.65
LMNA P02545 3/20 0.65
RECQL P46063 2/20 0.65
MAOB P27338 2/20 0.65
THRB P10828 2/20 0.65
PKM P14618 2/20 0.65
RAB9A P51151 2/20 0.65
CASP6 P55212 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
CA12 O43570 1/20 0.65
CA1 P00915 1/20 0.65

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
SCHEMBL11838896 0.91 MAPT (0.84) MEN1KMT2AMAPTBLMGAA
SCHEMBL8082984 0.89 MAPT (0.82) MEN1KMT2AMAPTBLMGAA
SCHEMBL4667164 0.86 MAPT (1.00) MEN1KMT2AMAPTBLMGAA
Hydrochloric Acid SCHEMBL5107977 0.85 F2 (0.71) MEN1KMT2AMAPTBLMGAA
SCHEMBL12310114 0.84 MAPT (0.66) MEN1KMT2AMAPTBLMGAA
SCHEMBL1465278 0.84 KMT2A (0.70) MEN1KMT2AMAPTGAAALDH1A1
SCHEMBL15458727 0.84 MAPT (0.73) MEN1KMT2AMAPTBLMGAA
SCHEMBL4241915 0.83 HTT (0.64) MAPTGAAALDH1A1L3MBTL1LMNA
SCHEMBL4337813 0.83 MEN1 (0.68) MEN1KMT2AMAPTGAAALDH1A1
SCHEMBL6806474 0.82 MAPT (0.72) MEN1KMT2AMAPTBLMGAA

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-104418783-B Preparation method of ezetimibe SSS isomer 江苏豪森药业集团有限公司 2020-08-07 CN disclosed
CN-105439929-A Synthesis process of ezetimibe intermediate SHANGHAI HENGSHENG PHARMACEUTICAL CO LTD 2016-03-30 CN disclosed
CN-102358723-A Preparation method of N-(4-fluorophenyl)-4-benzyloxy benzylidene amine UNIV ZHEJIANG 2012-02-22 CN disclosed
CN-102358723-A Preparation method of N-(4-fluorophenyl)-4-benzyloxy benzylidene amine UNIV ZHEJIANG 2012-02-22 CN disclosed
WO-2010097350-A1 A PROCESS FOR THE PREPARATION OF AN ALDEHYDE BETA-LACTAM COMPOUND ADAMED SP. Z O.O. (PL) 2010-09-02 WO disclosed