SCHEMBL11750010

SCHEMBL11750010

CCOC(=O)C1C(=O)CNC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.40
TLR4 O00206 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
RAB9A P51151 1/20 0.37
PPM1B O75688 1/20 0.37
PTPN1 P18031 1/20 0.37
POLB P06746 1/20 0.37
PPP1CC P36873 1/20 0.37
HTT P42858 1/20 0.36

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
SCHEMBL16931286 0.84 POLB (0.39) TDP2TLR4KDM4EALDH1A1MAPT
SCHEMBL4768534 0.73 TDP2 (0.39) TDP2KDM4EALDH1A1MAPTMEN1
SCHEMBL30485522 0.73 KDM4E (0.44) TDP2KDM4EALDH1A1MAPTMEN1
SCHEMBL14902253 0.72
SCHEMBL15228648 0.72 POLB (0.39) TDP2KDM4EALDH1A1MAPTMEN1
SCHEMBL9724627 0.71 CYP1A2 (0.41) ALDH1A1MAPTPDE4APDE4BPDE4C
SCHEMBL354474 0.71 ALDH1A1 (0.48) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9782199 0.70 MAPT (0.47) TLR4KDM4EALDH1A1MAPTMEN1
SCHEMBL10831751 0.70 L3MBTL1 (0.39) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL23732676 0.69

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
US-4003911-A ANTISECRETORY AGENTS, OXYTOCICS, BRONCHODILATORS, PLASTICIZERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-01-18 US disclosed