SCHEMBL4072383

SCHEMBL4072383

CCN1CC2=C(CC1=O)C1(CCN(C(=O)OC(C)(C)C)CC1)OC2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AVPR1A P37288 3/20 0.38
▸ USP2 O75604 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ DDB1 Q16531 1/20 0.36
▸ CRBN Q96SW2 1/20 0.36
▸ NAMPT P43490 6/20 0.35
▸ GPR119 Q8TDV5 1/20 0.33
▸ MCHR1 Q99705 1/20 0.33
▸ NPC1L1 Q9UHC9 1/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ JAK1 P23458 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL1002845 0.85 AVPR1A (0.39) AVPR1AUSP2SMN1; SMN2DDB1CRBN
SCHEMBL4069310 0.81 AVPR1A (0.39) AVPR1AUSP2SMN1; SMN2DDB1CRBN
SCHEMBL4067697 0.76 CRBN (0.40) AVPR1AUSP2SMN1; SMN2DDB1CRBN
SCHEMBL4074130 0.76 CRBN (0.39) AVPR1AUSP2SMN1; SMN2DDB1CRBN
SCHEMBL21843465 0.74 USP2 (0.49) AVPR1AUSP2SMN1; SMN2DDB1CRBN
SCHEMBL14720194 0.74 USP2 (0.40) USP2SMN1; SMN2DDB1CRBNGPR119
SCHEMBL3495197 0.71 USP2 (0.42) USP2SMN1; SMN2DDB1CRBNNAMPT
SCHEMBL10111390 0.70 USP2 (0.41) USP2SMN1; SMN2DDB1CRBNNAMPT
SCHEMBL4072375 0.69 AVPR1A (0.45) AVPR1AUSP2SMN1; SMN2NAMPTGPR119
SCHEMBL17317373 0.68 OPRM1 (0.45) USP2SMN1; SMN2DDB1CRBNGPR119

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
EP-2072519-A1 DIARYL KETIMINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-06-24 — — EP disclosed
Send feedback