SCHEMBL6279641

SCHEMBL6279641

CCCCC1CCC=C1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CHRNA7 P36544 1/20 0.33
USP2 O75604 1/20 0.32
GAA P10253 1/20 0.32
HCAR2 Q8TDS4 3/20 0.31
PTGER2 P43116 1/20 0.31
ALOX5 P09917 1/20 0.31
CYP19A1 P11511 1/20 0.31
DPP4 P27487 2/20 0.31
TLR4 O00206 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
Methacrylic Acid SCHEMBL1904964 0.91 TLR4 (0.32) CHRNB2CHRNA4ALDH1A1CHRNA7TLR4
SCHEMBL1463307 0.82 CHRNB2 (0.36) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL8384281 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL19181187 0.79 ALDH1A1 (0.53) ALDH1A1
SCHEMBL18487399 0.77 CA2 (0.36) ALDH1A1
SCHEMBL5344387 0.72 F2 (0.35)
SCHEMBL6375631 0.71 ALOX5 (0.33) ALDH1A1USP2GAAHCAR2ALOX5
SCHEMBL7691438 0.71 CYSLTR2 (0.35) ALDH1A1HCAR2ALOX5CYP1A2
SCHEMBL28276478 0.68 ABL1 (0.38) MAPTALDH1A1
SCHEMBL18998427 0.68 PTGS2 (0.35) ALOX5

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-2603555-B1 POLYMER FOAM TRISTANO PTY LTD (AU) 2017-02-15 EP claimed
EP-2231393-B1 HIGHLY FLAME RETARDANT PANELS DU PONT (US) 2013-01-23 EP claimed
JP-2005163052-A PLASTIC MATERIAL FOR PACKAGE E I DU PONT DE NEMOURS & CO 2005-06-23 JP disclosed