SCHEMBL2014179

SCHEMBL2014179

CC(C)(C)OC(=O)CN1CCc2ccccc2C1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.56
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
ALDH1A1 P00352 1/20 0.53
PRMT5 O14744 4/20 0.52
WDR77 Q9BQA1 4/20 0.52
MAPT P10636 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
RAB9A P51151 1/20 0.49
GFER P55789 1/20 0.49

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
SCHEMBL29676683 0.90 DRD2 (0.46) DRD2KMT2AALDH1A1PRMT5WDR77
SCHEMBL12953718 0.84 ALDH1A1 (0.47) DRD2KMT2AMEN1ALDH1A1MAPT
SCHEMBL5862011 0.84 KMT2A (0.61) KMT2AMEN1ALDH1A1PRMT5WDR77
SCHEMBL31108108 0.83 CARM1 (0.49) DRD2KMT2AMEN1ALDH1A1PRMT5
SCHEMBL1015138 0.83 CARM1 (0.49) DRD2KMT2AMEN1ALDH1A1PRMT5
SCHEMBL12952775 0.83 ESR2 (0.46) DRD2KMT2AMEN1ALDH1A1PRMT5
SCHEMBL23810739 0.82 CARM1 (0.50) DRD2
SCHEMBL30955054 0.82 CARM1 (0.50) DRD2ALDH1A1PRMT5WDR77
SCHEMBL12984530 0.82 KCNQ2 (0.41) DRD2KMT2AMEN1ALDH1A1PRMT5
SCHEMBL23348748 0.82 CARM1 (0.50) DRD2ALDH1A1PRMT5WDR77

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
WO-2011073269-A1 PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO disclosed
WO-2011073276-A1 BENZOXAZINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO disclosed