SCHEMBL2445561

SCHEMBL2445561

NC(=O)CCCCC(=O)N1Cc2cccc(c2)C1.NC(=O)c1cccc(C(=O)N2Cc3cccc(c3)C2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
PARP1 P09874 6/20 0.36
HSD17B10 Q99714 1/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
PARP10 Q53GL7 3/20 0.34
L3MBTL3 Q96JM7 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HSP90B1 P14625 1/20 0.34
TRAP1 Q12931 1/20 0.34
HPGD P15428 1/20 0.34
PARP14 Q460N5 1/20 0.34

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
SCHEMBL4560033 0.95 MEN1 (0.43) MEN1KMT2ALMNATSHRPARP1
SCHEMBL8848524 0.92 HPGD (0.45) MEN1KMT2ALMNATSHRMAPK1
SCHEMBL692631 0.89 OPRM1 (0.42) MEN1KMT2ASMN1; SMN2PARP1HSD17B10
SCHEMBL874967 0.87 PARP1 (0.46) MEN1KMT2ALMNATSHRMAPK1
SCHEMBL170540 0.87 LMNA (0.41) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL28397359 0.85 HDAC3 (0.41) LMNAMAPTF2
SCHEMBL28392745 0.85 HDAC3 (0.41) LMNAMAPTF2
SCHEMBL8962572 0.84 LMNA (0.40) LMNATSHRSMN1; SMN2HSD17B10MAPT
SCHEMBL3751631 0.82 HPGD (0.44) LMNAMAPK1SMN1; SMN2ALDH1A1HPGD
SCHEMBL2406643 0.81 HPGD (0.51) MEN1KMT2ALMNATSHRMAPK1

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-111183023-B Laminated tube 宇部兴产株式会社 2022-02-25 CN disclosed
CN-111183023-A Laminated tube 宇部兴产株式会社 2020-05-19 CN disclosed
CN-111163927-A Laminated tube 宇部兴产株式会社 2020-05-15 CN disclosed
CN-111094454-A Polyamide resin composition, and polyamide resin composition for rotational molding and rotational molded article using same 宇部兴产株式会社 2020-05-01 CN disclosed
EP-2365033-A1 Impact-resistant modified polyamide moulding material and container made of same EMS-PATENT AG (CH) 2011-09-14 EP disclosed