SCHEMBL7969507

SCHEMBL7969507

CCOC(=O)c1cn(C2CCC(C)(O)CC2)c2ncccc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.52
TDP1 Q9NUW8 1/20 0.39
ADRB2 P07550 1/20 0.38
CNR2 P34972 1/20 0.38
MAOB P27338 2/20 0.37
OPRK1 P41145 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ATM Q13315 1/20 0.37
TYK2 P29597 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL7953666 0.91 ELANE (0.58) ELANETDP1ADRB2MAOBOPRK1
SCHEMBL7954868 0.89 ELANE (0.56) ELANETDP1OPRK1ALDH1A1ATM
SCHEMBL7966469 0.89 ELANE (0.56) ELANETDP1ADRB2OPRK1ALDH1A1
SCHEMBL7946372 0.88 ELANE (0.55) ELANETDP1OPRK1PKMMAPK1
SCHEMBL7955441 0.88 ELANE (0.49) ELANETDP1ADRB2MAOBALDH1A1
SCHEMBL7960265 0.87 ELANE (0.54) ELANETDP1ADRB2MAOBOPRK1
SCHEMBL7966421 0.87 ELANE (0.54) ELANETDP1ADRB2MAOBOPRK1
SCHEMBL7966257 0.86 ELANE (0.53) ELANETDP1ADRB2MAOBOPRK1
SCHEMBL7960167 0.86 ELANE (0.53) ELANETDP1ADRB2MAOBOPRK1
SCHEMBL7966256 0.86 ELANE (0.53) ELANETDP1ADRB2MAOBOPRK1

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-6331548-B1 PREVENTION OR TREATMENT OF CYTOKINE RELATED DISEASES SUNTORY LIMITED (JP) 2001-12-18 US disclosed
EP-0978516-A1 1-CYCLOALKYL-1,8-NAPHTHYRIDIN-4-ONE DERIVATIVES WITH PHOSPHODIESTERASE IV INHIBITORY ACTIVITY SUNTORY LIMITED (JP) 2000-02-09 EP disclosed