SCHEMBL8962572

SCHEMBL8962572

NC(=O)C(N)=O.NC(=O)CCCCC(=O)N1Cc2cccc(c2)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
TPSAB1 Q15661 4/20 0.35
TPSD1 Q9BZJ3 4/20 0.35
TPSG1 Q9NRR2 4/20 0.35
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
NAMPT P43490 1/20 0.34
F2 P00734 2/20 0.34
HPGD P15428 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL170540 0.97 LMNA (0.41) LMNAMAPTNPSR1HDAC3HDAC1
SCHEMBL28392745 0.95 HDAC3 (0.41) LMNAMAPTNPSR1HDAC3HDAC1
SCHEMBL28397359 0.95 HDAC3 (0.41) LMNAMAPTNPSR1HDAC3HDAC1
SCHEMBL28528392 0.89 ALDH1A1 (0.39) LMNAMAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL4439473 0.88 HDAC3 (0.37) LMNAMAPTNPSR1HDAC3HDAC1
SCHEMBL4560033 0.88 MEN1 (0.43) LMNAMAPTNPSR1TSHR
SCHEMBL8518592 0.84 ALDH1A1 (0.49) LMNAMAPTNPSR1HDAC3HDAC1
SCHEMBL2445561 0.84 MEN1 (0.40) LMNAMAPTTSHRSMN1; SMN2KDM4E
SCHEMBL170857 0.83 LMNA (0.42) LMNAMAPTNPSR1HDAC3HDAC1
SCHEMBL17351915 0.81 L3MBTL1 (0.49) LMNAMAPTALDH1A1NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0515553-B1 OXYGEN BARRIER EXXON CHEMICAL PATENTS INC (US) 1996-02-07 EP disclosed
US-5391640-A A molding material blends consisting of a polyamide or a polylactam homopolymer and a polyamide copolymer which has aminoalkanoic acids, diamines and dicarboxylic acids monomer; vapor barriers; waterproofing, permselectivity ALLIEDSIGNAL INC. (US) 1995-02-21 US disclosed
EP-0636161-A1 MISCIBLE THERMOPLASTIC COMPOSITIONS CONTAINING POLYAMIDE/AMORPHOUS POLYAMIDE BLENDS. ALLIED SIGNAL INC (US) 1995-02-01 EP disclosed
WO-1993021276-A1 MISCIBLE THERMOPLASTIC COMPOSITIONS CONTAINING POLYAMIDE/AMORPHOUS POLYAMIDE BLENDS ALLIED-SIGNAL INC. (US) 1993-10-28 WO disclosed
US-5093466-A Food packaging EXXON CHEMICAL PATENTS INC. (US) 1992-03-03 US disclosed
WO-1991013113-A1 OXYGEN BARRIER EXXON CHEMICAL PATENTS INC. (US) 1991-09-05 WO disclosed