SCHEMBL7499320

SCHEMBL7499320

CC(=O)Oc1ccc(CCC(=O)O)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
MAPT P10636 5/20 0.49
KDM4E B2RXH2 5/20 0.49
PKM P14618 4/20 0.49
CYP2C19 P33261 2/20 0.49
DDAH1 O94760 1/20 0.49
CYP1A2 P05177 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HSD17B10 Q99714 3/20 0.49
HTT P42858 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
POLB P06746 1/20 0.49
HPGD P15428 4/20 0.45
TSHR P16473 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GFER P55789 1/20 0.45
PPARG P37231 1/20 0.45
NCOA2 Q15596 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
NCOR2 Q9Y618 1/20 0.45

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
SCHEMBL28023102 0.81 ALDH1A1 (0.33) ALDH1A1MAPTKDM4EPKMCYP2C19
SCHEMBL27858874 0.79 ALDH1A1 (0.41) ALDH1A1MAPTKDM4ECYP1A2SMN1; SMN2
SCHEMBL17491872 0.78 ALDH1A1 (0.66) ALDH1A1MAPTKDM4EPKMCYP2C19
SCHEMBL27472113 0.77 ALDH1A1 (0.35) ALDH1A1MAPTKDM4EPKMSMN1; SMN2
SCHEMBL17077645 0.77 CYP2E1 (0.35) ALDH1A1MAPTKDM4EPKMCYP2C19
SCHEMBL17693418 0.77 ALDH1A1 (0.49) ALDH1A1MAPTKDM4EPKMCYP2C19
SCHEMBL28057100 0.73 ALDH1A1 (0.40) ALDH1A1MAPTKDM4ESMN1; SMN2HSD17B10
SCHEMBL27373829 0.73 PTGS2 (0.38) ALDH1A1MAPTKDM4ESMN1; SMN2HSD17B10
SCHEMBL9116093 0.73 ALDH1A1 (0.56) ALDH1A1MAPTKDM4EPKMCYP2C19
SCHEMBL8342486 0.73 ALDH1A1 (0.60) ALDH1A1MAPTKDM4EPKMCYP2C19

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0734386-B1 PLATELET ACTIVATING FACTOR ANTAGONISTS: IMIDAZOPYRIDINE INDOLES ABBOTT LAB (US) 2002-02-06 EP disclosed
EP-0734386-A1 PLATELET ACTIVATING FACTOR ANTAGONISTS: IMIDAZOPYRIDINE INDOLES Abbott Laboratories (US) 1996-10-02 EP disclosed
US-5486525-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1996-01-23 US disclosed
WO-1995016687-A1 PLATELET ACTIVATING FACTOR ANTAGONISTS: IMIDAZOPYRIDINE INDOLES ABBOTT LABORATORIES (US) 1995-06-22 WO disclosed