SCHEMBL8710595

SCHEMBL8710595

O=C1CCC(Sc2ccccc2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.45
DDB1 Q16531 1/20 0.45
F2 P00734 2/20 0.39
PRSS1 P07477 2/20 0.39
CARM1 Q86X55 1/20 0.37
PRMT6 Q96LA8 1/20 0.37
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
GAA P10253 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP19A1 P11511 1/20 0.33
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
CYP3A4 P08684 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
SCHEMBL4700938 0.88 CRBN (0.47) CRBNDDB1F2PRSS1CARM1
SCHEMBL102816 0.74 CARM1 (0.50) CRBNDDB1F2PRSS1CARM1
SCHEMBL12110641 0.74 CARM1 (0.50) CRBNDDB1F2PRSS1CARM1
SCHEMBL8707567 0.73 ESR2 (0.35) CRBNDDB1F2PRSS1CARM1
SCHEMBL8707565 0.73 ESR2 (0.35) CRBNDDB1F2PRSS1CARM1
SCHEMBL24483956 0.73 DDB1 (0.38) CRBNDDB1F2PRSS1CARM1
SCHEMBL24483499 0.73 DDB1 (0.38) CRBNDDB1F2PRSS1CARM1
SCHEMBL14369929 0.72 CRBN (0.46) CRBNDDB1MAPTALDH1A1KMT2A
SCHEMBL5005486 0.72 CRBN (0.46) CRBNDDB1MAPTALDH1A1GRIN1
SCHEMBL17902671 0.70 DDB1 (0.54) CRBNDDB1F2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0693054-B1 CYCLOALKYLHYDROXYUREAS AND THEIR USE AS LIPOXYGENASE INHIBITORS PFIZER (US) 1998-06-10 EP disclosed
US-5681858-A Cycloalkyl hydroxyureas PFIZER INC. (US) 1997-10-28 US disclosed
EP-0693054-A1 CYCLOALKYLHYDROXYUREAS AND THEIR USE AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1996-01-24 EP disclosed
WO-1994022814-A1 CYCLOALKYLHYDROXYUREAS AND THEIR USE AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1994-10-13 WO disclosed