SCHEMBL7474699

SCHEMBL7474699

Cc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)c2cc(N)ccc2n1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 2/20 0.52
MAP4K4 O95819 1/20 0.50
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
SMARCA2 P51531 1/20 0.47
SMARCA4 P51532 1/20 0.47
PBRM1 Q86U86 1/20 0.47
CKS1B P61024 2/20 0.47
SKP1 P63208 2/20 0.47
SKP2 Q13309 2/20 0.47
NR1H2 P55055 1/20 0.46
SMPD3 Q9NY59 1/20 0.45
KIT P10721 1/20 0.45
GBA1 P04062 2/20 0.44
PTPN11 Q06124 1/20 0.44
PIK3CA P42336 2/20 0.44
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL5523102 0.85 NCF1 (0.72) NCF1KMT2AMEN1CKS1BSKP1
SCHEMBL7467892 0.83 MAP4K4 (0.51) MAP4K4KMT2AMEN1SMARCA2SMARCA4
SCHEMBL7471109 0.83 MAPT (0.59) NCF1KMT2AMEN1ALDH1A1
SCHEMBL5759182 0.80 NCF1 (0.52) NCF1MAP4K4KMT2AMEN1SMARCA2
SCHEMBL29569426 0.78 NR1H2 (0.54) MAP4K4KMT2AMEN1SMARCA2SMARCA4
SCHEMBL116544 0.78 NR1H2 (0.54) MAP4K4KMT2AMEN1SMARCA2SMARCA4
SCHEMBL5383294 0.78 NR1H2 (0.54) MAP4K4KMT2AMEN1SMARCA2SMARCA4
SCHEMBL7472712 0.78 MAP4K4 (0.48) MAP4K4KMT2AMEN1SMARCA2SMARCA4
SCHEMBL6308917 0.78 BACE1 (0.51) MAP4K4SMARCA2SMARCA4PBRM1CKS1B
SCHEMBL16417060 0.78 KIT (0.48) MAP4K4SMARCA2SMARCA4PBRM1CKS1B

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-1228066-A2 SULFONAMIDE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2002-08-07 EP disclosed
WO-2001032646-A2 SULFONAMIDE DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-10 WO disclosed