SCHEMBL11861985

SCHEMBL11861985

CCc1cc(=O)oc(C)c1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.58
TSHR P16473 3/20 0.58
ALDH1A1 P00352 11/20 0.49
MAPT P10636 4/20 0.49
ALDH1A2 O94788 1/20 0.49
ALDH2 P05091 1/20 0.49
ALDH1B1 P30837 1/20 0.49
ALDH1A3 P47895 1/20 0.49
HPGD P15428 4/20 0.44
GAA P10253 2/20 0.44
HTT P42858 2/20 0.44
MAPK1 P28482 1/20 0.44
PPARG P37231 1/20 0.44
MAPK10 P53779 1/20 0.44
NCOA2 Q15596 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HSD17B10 Q99714 2/20 0.42
POLB P06746 1/20 0.42
HCAR2 Q8TDS4 2/20 0.42
HSD17B3 P37058 1/20 0.42

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
SCHEMBL13824371 0.73 KDM4E (0.46) KDM4ETSHRALDH1A1ALDH1A2ALDH2
SCHEMBL2574998 0.70 CYP3A4 (0.46) KDM4ETSHRALDH1A1MAPTHPGD
SCHEMBL7963459 0.68 ALDH1A1 (0.45) KDM4ETSHRALDH1A1MAPTHPGD
SCHEMBL1262846 0.64 KMT2A (0.36) TSHRALDH1A1MAPTHPGDGAA
SCHEMBL11854129 0.64 MAPT (0.64) KDM4ETSHRALDH1A1MAPTHPGD
SCHEMBL15030959 0.64 ALDH1A1 (0.50) KDM4ETSHRALDH1A1MAPTHPGD
SCHEMBL3031292 0.64
SCHEMBL9802626 0.63 ALDH1A1 (0.46) KDM4ETSHRALDH1A1HPGDGAA
SCHEMBL23520162 0.63 HCAR2 (0.41) KDM4ETSHRALDH1A1MAPTHPGD
SCHEMBL15842559 0.63 ALDH1A1 (0.51) KDM4ETSHRALDH1A1MAPTHPGD

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-3972888-A Process for the preparation of 1-hydroxy-pyridones HOECHST AKTIENGESELLSCHAFT (DT) 1976-08-03 US disclosed