SCHEMBL6557587

SCHEMBL6557587

C=CC(=O)CCCCC(=O)C=C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
TSHR P16473 6/20 0.50
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 2/20 0.40
ABCC4 O15439 1/20 0.40
LMNA P02545 4/20 0.39
FGFR4 P22455 1/20 0.37
FAAH O00519 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
CYP3A4 P08684 1/20 0.36
TRPA1 O75762 1/20 0.36
NFKB1 P19838 1/20 0.35
PMP22 Q01453 1/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL23631357 0.97 TSHR (0.48) ALDH1A1TSHRSMN1; SMN2MAPTABCC4
SCHEMBL8738053 0.97 TSHR (0.48) ALDH1A1TSHRSMN1; SMN2MAPTABCC4
SCHEMBL22492168 0.97 TSHR (0.48) ALDH1A1TSHRSMN1; SMN2MAPTABCC4
SCHEMBL18623650 0.97 TSHR (0.48) ALDH1A1TSHRSMN1; SMN2MAPTABCC4
SCHEMBL2691938 0.97 TSHR (0.48) ALDH1A1TSHRSMN1; SMN2MAPTABCC4
SCHEMBL1988202 0.93 ALDH1A1 (0.50) ALDH1A1TSHRSMN1; SMN2MAPTABCC4
SCHEMBL9575278 0.89
SCHEMBL6283879 0.89 LMNA (0.58) ALDH1A1TSHRMAPTABCC4LMNA
SCHEMBL28441276 0.89
SCHEMBL11666292 0.87 GPR84 (0.50) ALDH1A1TSHRSMN1; SMN2MAPTABCC4

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-114213654-A Preparation method of cationic polyamide wet strength agent, product and application thereof 浙江百斯特化工有限公司 2022-03-22 CN disclosed
EP-1051454-B1 LIQUID-CRYSTALLINE PHOTOCROSSLINKABLE MIXTURE ROLIC AG (CH) 2004-03-10 EP disclosed
US-6548127-B1 Reducing the formation of tilt domains by mixing two non-crosslinked monomers each with two terminal polymerizable groups with anon-liquid-crystalline monomer, and crosslinking; optical or electrooptical devices ROLIC AG (CH) 2003-04-15 US disclosed