SCHEMBL4387103

SCHEMBL4387103

CCOC(=O)[C@@H]1C2CCC(C2)C1N

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.44
PTPN1 P18031 1/20 0.44
PPP1CC P36873 1/20 0.44
ALDH1A1 P00352 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
MEN1 O00255 1/20 0.40
CYP2C9 P11712 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 2/20 0.36
KCNH2 Q12809 1/20 0.35
SMYD3 Q9H7B4 1/20 0.35
TSHR P16473 1/20 0.35
ALOX15 P16050 1/20 0.34

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
SCHEMBL2688628 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL334921 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL3351227 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL6126545 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL14151679 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL14151678 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL4420799 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL4941984 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL182454 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2
SCHEMBL4941987 1.00 PPM1B (0.44) PPM1BPTPN1PPP1CCALDH1A1CYP1A2

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-2129224-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS Anadys Pharmaceuticals, Inc. (US) 2009-12-09 EP disclosed
WO-2008124450-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. (US) 2008-10-16 WO disclosed