SCHEMBL7963299

SCHEMBL7963299

COCC(=O)C1C(=O)CC(C)CC1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 3/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
CRBN Q96SW2 1/20 0.31
TLR4 O00206 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL10192815 0.80 ALDH1A1 (0.42) ALDH1A1KDM4EPOLBMAPTTSHR
SCHEMBL7965133 0.79 ALDH1A1 (0.38) ALDH1A1KDM4EPOLBMAPTTSHR
SCHEMBL10595738 0.74 HSD17B10 (0.48) ALDH1A1KDM4EPOLBMAPTTSHR
SCHEMBL4264381 0.70 CRBN (0.39) CRBNTLR4NPSR1
SCHEMBL13242146 0.69 CRBN (0.37) CRBN
SCHEMBL10534278 0.68 TLR4 (0.64) ALDH1A1KDM4EPOLBTLR4ALOX15
SCHEMBL14441739 0.67 TLR4 (0.36) TLR4NPSR1
SCHEMBL10591889 0.65 ALDH1A1 (0.35) ALDH1A1MAPTCRBNTLR4
SCHEMBL18998460 0.64
SCHEMBL15032678 0.64 MAPK1 (0.44) TLR4MAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6215016-B1 HEMATOPOIETIC AGENTS; PREVENTING CYTOPENIA TORAY INDUSTRIES, INC. (JP) 2001-04-10 US disclosed
EP-0841063-A1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1998-05-13 EP disclosed