SCHEMBL7946372

SCHEMBL7946372

CCOC(=O)c1cn(C2CCCCC2)c2ncccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.55
KDM4E B2RXH2 1/20 0.46
OPRK1 P41145 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
TDP1 Q9NUW8 1/20 0.42
MAPK1 P28482 1/20 0.42
HTR3A P46098 1/20 0.41
PKM P14618 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL7954868 0.99 ELANE (0.56) ELANEKDM4EOPRK1KMT2AMEN1
SCHEMBL7966469 0.97 ELANE (0.56) ELANEKDM4EOPRK1KMT2AMEN1
SCHEMBL7953666 0.95 ELANE (0.58) ELANEOPRK1TDP1MAPK1HTR3A
SCHEMBL7966421 0.91 ELANE (0.54) ELANEOPRK1KMT2AMEN1TDP1
SCHEMBL7960265 0.91 ELANE (0.54) ELANEOPRK1KMT2AMEN1TDP1
SCHEMBL7966257 0.90 ELANE (0.53) ELANEOPRK1TDP1HTR3APKM
SCHEMBL7966256 0.90 ELANE (0.53) ELANEOPRK1TDP1HTR3APKM
SCHEMBL7960167 0.90 ELANE (0.53) ELANEKDM4EOPRK1TDP1MAPK1
SCHEMBL7969507 0.88 ELANE (0.52) ELANEOPRK1TDP1MAPK1PKM
SCHEMBL7957249 0.86 ELANE (0.52) ELANEHTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6331548-B1 PREVENTION OR TREATMENT OF CYTOKINE RELATED DISEASES SUNTORY LIMITED (JP) 2001-12-18 US disclosed