SCHEMBL7514643

SCHEMBL7514643

CC(C)(C)OC(=O)NCC1CCN(c2c(F)cc(C(=O)N(N)C(=O)O)c(NC3CC3)c2Cl)C1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACACB O00763 11/20 0.41
ACACA Q13085 10/20 0.41
SUV39H2 Q9H5I1 3/20 0.38
DRD2 P14416 1/20 0.37
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37
MDM2 Q00987 1/20 0.34
PRMT5 O14744 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
SCHEMBL7514863 0.89 IRAK1 (0.37) ACACBACACASUV39H2DRD2PRMT5
SCHEMBL4506830 0.86 ACACB (0.41) ACACBACACASUV39H2DRD2CKS1B
SCHEMBL7517651 0.84 ACACB (0.39) ACACBACACASUV39H2DRD2CKS1B
SCHEMBL7515377 0.82 DRD2 (0.30) DRD2
SCHEMBL4525305 0.82 PRMT5 (0.39) ACACBACACASUV39H2DRD2PRMT5
SCHEMBL4501738 0.82 ACACB (0.43) ACACBACACASUV39H2DRD2CKS1B
SCHEMBL7554372 0.81 KDM4D (0.38) SUV39H2DRD2
SCHEMBL4512791 0.80 KCNH2 (0.43) ACACBACACASUV39H2CKS1BSKP1
SCHEMBL4506561 0.78 ACACB (0.40) ACACBACACASUV39H2DRD2CKS1B
SCHEMBL4500327 0.78 ACACB (0.42) ACACBACACASUV39H2DRD2CKS1B

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-1255739-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2002-11-13 EP disclosed
WO-2001053273-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2001-07-26 WO disclosed