SCHEMBL15859554

SCHEMBL15859554

COC(=O)Nc1ccc(Cc2ccccc2NC(=O)OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.54
RAB9A P51151 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 2/20 0.51
HPGD P15428 1/20 0.50
ALDH1A1 P00352 3/20 0.47
MAPT P10636 3/20 0.46
LMNA P02545 3/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
PKM P14618 1/20 0.46
SAE1 Q9UBE0 2/20 0.45
UBA2 Q9UBT2 2/20 0.45
HTT P42858 2/20 0.44
POLB P06746 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL2095643 0.89 L3MBTL1 (0.67) L3MBTL1RAB9ASMN1; SMN2NPC1HPGD
SCHEMBL7788545 0.87 RAB9A (0.56) L3MBTL1RAB9ASMN1; SMN2NPC1HPGD
SCHEMBL1836106 0.85 L3MBTL1 (0.51) L3MBTL1RAB9ASMN1; SMN2NPC1HPGD
SCHEMBL2097449 0.82 SMN1; SMN2 (0.67) RAB9ASMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL1022686 0.82 SMN1; SMN2 (0.64) RAB9ASMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL18454956 0.80 L3MBTL1 (0.56) L3MBTL1RAB9ASMN1; SMN2NPC1HPGD
SCHEMBL20077660 0.80 NPC1 (0.43) L3MBTL1RAB9ASMN1; SMN2NPC1HPGD
SCHEMBL28832931 0.80 L3MBTL1 (0.54) L3MBTL1NPC1ALDH1A1MAPTLMNA
SCHEMBL4621396 0.80 L3MBTL1 (0.58) L3MBTL1HPGDALDH1A1LMNAKMT2A
SCHEMBL2463257 0.79 HPGD (0.46) L3MBTL1RAB9ASMN1; SMN2NPC1HPGD

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
EP-2752405-B1 METHOD FOR PREPARING POLYMETHYLENE POLYPHENYL POLYAMINO FORMATE INST PROCESS ENG CAS (CN) 2018-08-22 EP disclosed
US-20170137560-A1 POLYISOCYANATE MONOMER COMPOSITION FOR OPTICAL MEMBERS, AND OPTICAL MEMBER AND PRODUCTION METHOD THEREFOR HOYA LENS THAILAND LTD. (TH) 2017-05-18 US disclosed
US-9062161-B2 Method for preparing polymethylene polyphenyl polycarbamate INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2015-06-23 US disclosed
US-20140316100-A1 METHOD FOR PREPARING POLYMETHYLENE POLYPHENYL POLYCARBAMATE INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2014-10-23 US disclosed
EP-2752405-A1 METHOD FOR PREPARING POLYMETHYLENE POLYPHENYL POLYAMINO FORMATE Institute of Process Engineering, Chinese Academy of Sciences (CN) 2014-07-09 EP disclosed