SCHEMBL5218581

SCHEMBL5218581

Cc1cc(N2CCC(NC(=O)O)CC2)nc(C2CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.51
HPGD P15428 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TSHR P16473 3/20 0.49
ALDH1A1 P00352 2/20 0.49
CHRM3 P20309 4/20 0.46
PDE4A P27815 4/20 0.46
PDE4B Q07343 4/20 0.46
PDE4C Q08493 4/20 0.46
PDE4D Q08499 4/20 0.46
TDP1 Q9NUW8 1/20 0.44
HRH4 Q9H3N8 1/20 0.43
CKS1B P61024 1/20 0.43
SKP1 P63208 1/20 0.43
SKP2 Q13309 1/20 0.43
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL28761385 0.85 CKS1B (0.53) USP2HPGDSMN1; SMN2TSHRALDH1A1
SCHEMBL5218625 0.81 USP2 (0.50) USP2HPGDSMN1; SMN2TSHRALDH1A1
SCHEMBL5218982 0.81 GBA1 (0.52) USP2HPGDSMN1; SMN2TSHRALDH1A1
SCHEMBL19658491 0.77 CHRM3 (0.43) USP2HPGDSMN1; SMN2ALDH1A1CHRM3
SCHEMBL3281735 0.77 HPGD (0.47) USP2HPGDSMN1; SMN2TSHRALDH1A1
SCHEMBL21211937 0.76 CHRM3 (0.54) CHRM3PDE4APDE4BPDE4CPDE4D
SCHEMBL5220789 0.76 CKS1B (0.53) CKS1BSKP1SKP2
SCHEMBL28761386 0.75 GPR119 (0.39) USP2HPGDSMN1; SMN2TSHRALDH1A1
SCHEMBL19652228 0.74 CHRM3 (0.41) USP2HPGDSMN1; SMN2ALDH1A1CHRM3
SCHEMBL27902623 0.74 CKS1B (0.51) USP2HPGDSMN1; SMN2TSHRALDH1A1

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-1664025-B1 PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2007-09-19 EP disclosed