SCHEMBL10823979

SCHEMBL10823979

C=NC(=O)C(=C)C(=C)C(=C)C(=C)C(=C)CCC

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
FFAR3 O14843 3/20 0.32
HDAC3 O15379 3/20 0.32
HDAC1 Q13547 3/20 0.32
HDAC2 Q92769 3/20 0.32
HDAC8 Q9BY41 3/20 0.32
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL29016977 0.88 CES1 (0.38) CES2CES1ALDH1A1
SCHEMBL21439570 0.88 CES1 (0.38) CES2CES1ALDH1A1
SCHEMBL14476744 0.87
SCHEMBL17835451 0.86 CES2 (0.40) CES2CES1TSHRALDH1A1
SCHEMBL626654 0.85 CES1 (0.42) CES2CES1TSHRALDH1A1
SCHEMBL5029034 0.85 CES1 (0.42) CES2CES1TSHRALDH1A1
SCHEMBL15913814 0.83
SCHEMBL1147820 0.83
SCHEMBL5027339 0.82 CES1 (0.43) CES2CES1TSHRALDH1A1
SCHEMBL277530 0.76

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
CN-110177688-B Improved peel strength between dissimilar fabrics 霍尼韦尔国际公司 2021-12-07 CN disclosed
US-4601929-A Single-layer elastic tubular film of polyamide used for packaging paste substances and a process for the production of such film NATURIN-WERK BECKER & COMPANY (DE) 1986-07-22 US disclosed
US-4560520-A EXTRUSION, MULTIAXIAL STRETCHING, CONTROLLED SHRINKAGE, FIXING NATURIN-WERK BECKER & COMPANY (DE) 1985-12-24 US disclosed