SCHEMBL516791

SCHEMBL516791

CC1CCCC(N(C(=O)c2c(C(=O)O)ccc3cc(C(=O)O)ccc23)C2CCCC(C)C2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.39
SLC6A4 P31645 3/20 0.37
SLC6A2 P23975 2/20 0.35
SLC6A3 Q01959 2/20 0.35
ACE2 Q9BYF1 2/20 0.34
KDM4E B2RXH2 3/20 0.32
NCEH1 Q6PIU2 3/20 0.32
IKBKB O14920 1/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
NR4A1 P22736 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
RECQL P46063 1/20 0.32
ADAM17 P78536 1/20 0.32
LCK P06239 1/20 0.31

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
SCHEMBL518026 0.88 PTPN1 (0.44) PTPN1SLC6A4SLC6A2SLC6A3ACE2
SCHEMBL517351 0.87 PTPN1 (0.42) PTPN1SLC6A4SLC6A2SLC6A3ACE2
SCHEMBL517345 0.87 PTPN1 (0.43) PTPN1SLC6A4SLC6A2SLC6A3KDM4E
SCHEMBL517005 0.87 PTPN1 (0.43) PTPN1SLC6A4SLC6A2SLC6A3KDM4E
SCHEMBL517710 0.87 PTPN1 (0.43) PTPN1SLC6A4SLC6A2SLC6A3KDM4E
SCHEMBL1071845 0.82 SLC6A4 (0.49) PTPN1SLC6A4SLC6A2SLC6A3KDM4E
SCHEMBL518129 0.82 PTPN1 (0.39) PTPN1SLC6A4SLC6A2SLC6A3ACE2
SCHEMBL517319 0.82 PTPN1 (0.41) PTPN1ACE2KDM4ENCEH1
SCHEMBL517342 0.79 LMNA (0.44) SLC6A4SLC6A2SLC6A3KDM4EKMT2A
SCHEMBL27832853 0.77 PTPN1 (0.43) PTPN1ACE2KDM4EIKBKBKMT2A

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