SCHEMBL5536622

SCHEMBL5536622

CCC1=C(O)C(=O)C=C(C)C1=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XIAP P98170 3/20 0.68
ALOX5 P09917 17/20 0.43
MPEG1 Q2M385 11/20 0.43
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
MAPK1 P28482 3/20 0.43
KMT2A Q03164 3/20 0.43
GPR84 Q9NQS5 2/20 0.43
USP2 O75604 2/20 0.43
TP53 P04637 2/20 0.43
HPGD P15428 2/20 0.43
ALOX15 P16050 2/20 0.43
KAT2B Q92831 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
PTGES O14684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL9175113 0.81 XIAP (1.00) XIAPALOX5MPEG1KDM4EMEN1
SCHEMBL11790353 0.78 XIAP (0.41) XIAPALOX5KDM4EMEN1ALDH1A1
SCHEMBL17123718 0.78 ALOX5 (0.73) XIAPALOX5MPEG1KDM4EMEN1
SCHEMBL10606301 0.75 ALDH1A1 (0.50) XIAPALOX5MPEG1KDM4EMEN1
SCHEMBL789116 0.75 ALOX5 (0.67) XIAPALOX5MPEG1
SCHEMBL17123721 0.70 ALOX5 (0.50) XIAPALOX5MPEG1KDM4EMEN1
SCHEMBL10000759 0.70 ALDH1A1 (0.41) XIAPALOX5KDM4EMEN1ALDH1A1
SCHEMBL755506 0.69 ALDH1A1 (0.48) XIAPKDM4EMEN1ALDH1A1MAPT
SCHEMBL2137325 0.69 ALDH1A1 (0.48) XIAPKDM4EMEN1ALDH1A1MAPT
SCHEMBL10772074 0.69 XIAP (0.54) XIAPALOX5MPEG1KDM4EMEN1

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
US-20150175767-A1 BIOBASED IMPREGNATING COMPOSITION AND PRODUCTS COMPRISING SAME AFI LICENSING LLC 2015-06-25 US disclosed
EP-2886275-A2 Biobased impregnating composition and products comprising same Armstrong World Industries, Inc. (US) 2015-06-24 EP disclosed
US-7244418-B2 Antimicrobial artificial nail composition and methods for preparing and using same WOODWARD LABORATORIES, INC. (US) 2007-07-17 US disclosed
US-6479039-B1 Antimicrobial artificial nail composition and methods for preparing and using same WOODWARD LABORATORIES, INC. 2002-11-12 US disclosed
WO-2001003656-A1 ANTIMICROBIAL ARTIFICIAL NAIL COMPOSITION AND METHODS FOR PREPARING AND USING SAME WOODWARD LABORATORIES, INC. (US) 2001-01-18 WO disclosed