SCHEMBL7922109

SCHEMBL7922109

CBc1cccc2c1CC(CO)(NC(=O)OC(C)(C)C)C2

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.36
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
MME P08473 4/20 0.33
P2RX7 Q99572 1/20 0.33
EPHX2 P34913 1/20 0.33
NAMPT P43490 2/20 0.32
PPIA P62937 1/20 0.31
MAPK10 P53779 1/20 0.31
DRD2 P14416 5/20 0.30
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL7920547 0.84 MEN1 (0.38) GHSRDPP8DPP9PRMT5WDR77
SCHEMBL7918007 0.84 MEN1 (0.38) GHSRDPP8DPP9PRMT5WDR77
SCHEMBL7917719 0.76 GHSR (0.42) GHSRDPP8DPP9P2RX7EPHX2
SCHEMBL7923515 0.76 GHSR (0.42) GHSRDPP8DPP9DRD2
SCHEMBL7917374 0.75 GHSR (0.42) GHSRDPP8DPP9P2RX7EPHX2
SCHEMBL12203923 0.75 MEN1 (0.36) GHSRDPP8DPP9PRMT5WDR77
SCHEMBL7930810 0.71 DRD2 (0.46) GHSRDRD2
SCHEMBL7924669 0.71 GHSR (0.41) GHSRDPP8DPP9PPIA
SCHEMBL7918411 0.71 GHSR (0.41) GHSRDPP8DPP9PPIADRD2
SCHEMBL24437614 0.70 TDP1 (0.36) GHSRDPP8DPP9P2RX7PPIA

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
WO-2010042475-A1 SPIROAMINOOXAZOLINE ANALOGUES AS ALPHA2C ADRENERGIC RECEPTOR MODULATORS SCHERING CORPORATION (US) 2010-04-15 WO disclosed