SCHEMBL517345

SCHEMBL517345

O=C(O)c1ccc2c(C(=O)N(C3CCCCCCCCCCC3)C3CCCCCCCCCCC3)c(C(=O)O)ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.43
SLC6A4 P31645 3/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A3 Q01959 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
RECQL P46063 1/20 0.43
ADAM17 P78536 1/20 0.43
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
HSD11B1 P28845 3/20 0.39
S1PR1 P21453 2/20 0.38
S1PR3 Q99500 1/20 0.38
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL517710 1.00 PTPN1 (0.43) PTPN1SLC6A4SLC6A2SLC6A3LMNA
SCHEMBL517005 1.00 PTPN1 (0.43) PTPN1SLC6A4SLC6A2SLC6A3LMNA
SCHEMBL518026 0.99 PTPN1 (0.44) PTPN1SLC6A4SLC6A2SLC6A3LMNA
SCHEMBL1071845 0.95 SLC6A4 (0.49) PTPN1SLC6A4SLC6A2SLC6A3LMNA
SCHEMBL517342 0.91 LMNA (0.44) SLC6A4SLC6A2SLC6A3LMNAMEN1
SCHEMBL517351 0.88 PTPN1 (0.42) PTPN1SLC6A4SLC6A2SLC6A3KMT2A
SCHEMBL516791 0.87 PTPN1 (0.39) PTPN1SLC6A4SLC6A2SLC6A3LMNA
SCHEMBL517319 0.84 PTPN1 (0.41) PTPN1KDM4ES1PR1S1PR3
SCHEMBL22471663 0.83 WDR5 (0.46) SLC6A4SLC6A2SLC6A3LMNAMEN1
SCHEMBL518129 0.82 PTPN1 (0.39) PTPN1SLC6A4SLC6A2SLC6A3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2392458-B1 POLYPROPYLENE RESIN MOLDED ARTICLE NEW JAPAN CHEM CO LTD (JP) 2018-03-14 EP disclosed
US-20120028006-A1 POLYPROPYLENE RESIN MOLDED ARTICLE NEW JAPAN CHEMICAL CO., LTD. (JP) 2012-02-02 US disclosed
EP-2392458-A2 POLYPROPYLENE RESIN MOLDED ARTICLE New Japan Chemical Co., Ltd. (JP) 2011-12-07 EP disclosed