SCHEMBL517351

SCHEMBL517351

CC1CCC(N(C(=O)c2c(C(=O)O)ccc3cc(C(=O)O)ccc23)C2CCC(C)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.42
SLC6A4 P31645 3/20 0.37
ACE2 Q9BYF1 2/20 0.36
KDM4E B2RXH2 2/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
NR4A1 P22736 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A3 Q01959 2/20 0.35
USP2 O75604 1/20 0.35
RAB9A P51151 3/20 0.34
NPC1 O15118 2/20 0.34
MITF O75030 1/20 0.34
TP53 P04637 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 1/20 0.33

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 0.89 PTPN1 (0.44) PTPN1SLC6A4ACE2KDM4EHSD17B10
SCHEMBL517005 0.88 PTPN1 (0.43) PTPN1SLC6A4KDM4EGAAHSD17B10
SCHEMBL517710 0.88 PTPN1 (0.43) PTPN1SLC6A4KDM4EGAAHSD17B10
SCHEMBL517345 0.88 PTPN1 (0.43) PTPN1SLC6A4KDM4EGAAHSD17B10
SCHEMBL516791 0.87 PTPN1 (0.39) PTPN1SLC6A4ACE2KDM4EPOLB
SCHEMBL1071845 0.83 SLC6A4 (0.49) PTPN1SLC6A4KDM4EPOLBGAA
SCHEMBL517319 0.82 PTPN1 (0.41) PTPN1ACE2KDM4ENCEH1
SCHEMBL518129 0.81 PTPN1 (0.39) PTPN1SLC6A4ACE2KDM4ESLC6A2
SCHEMBL517342 0.79 LMNA (0.44) SLC6A4KDM4EGAAHSD17B10SLC6A2
SCHEMBL27832767 0.76 PTPN1 (0.47) PTPN1ACE2KDM4EPOLBGAA

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