SCHEMBL4437830

SCHEMBL4437830

Cc1ccccc1-c1nc2c(C)cccc2cc1CCO

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.50
ATM Q13315 1/20 0.50
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL1887556 0.88 PIK3CD (0.53) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL27781215 0.86 PIK3CD (0.50) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL3386976 0.86 PIK3CD (0.46) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL10285528 0.84 ATM (0.57) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1598219 0.82 ATM (0.52) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1598508 0.82 PIK3CD (0.53) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL4184546 0.82 PIK3CD (0.55) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL4437295 0.79 PIK3CD (0.49) PIK3CD
SCHEMBL1878618 0.79 ATM (0.52) PIK3CDATMDRD4DRD3L3MBTL1
SCHEMBL1886097 0.78 PIK3CD (0.64) PIK3CDATMDRD4DRD3L3MBTL1

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
EP-2137186-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2009-12-30 EP disclosed
WO-2008118468-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2008-10-02 WO disclosed