SCHEMBL14289677

SCHEMBL14289677

Cc1cc(Oc2cccc(N)c2)ccc1Br

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.56
ALDH1A1 P00352 5/20 0.50
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
CYP3A4 P08684 2/20 0.48
MITF O75030 1/20 0.48
GAA P10253 1/20 0.48
GFER P55789 1/20 0.48
NLRP1 Q9C000 1/20 0.48
NOD2 Q9HC29 1/20 0.48
ATM Q13315 1/20 0.46
POLB P06746 1/20 0.46
HSP90AA1 P07900 1/20 0.46
HAO1 Q9UJM8 1/20 0.45
TP53 P04637 1/20 0.44
LTA4H P09960 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL7569627 0.86 MAOB (0.60) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL1128842 0.82 HAO1 (0.50) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL3278046 0.79 MAOB (0.56) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL29799718 0.79 MAOB (0.56) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL29363390 0.79 MAOB (0.86) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL29352463 0.79 MAOB (0.86) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL1270913 0.79 MAOB (0.86) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL128748 0.79 MAOB (0.86) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL204267 0.79 MAOB (0.86) MAOBALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL55303 0.79 MAOB (0.86) MAOBALDH1A1MAPTSMN1; SMN2MEN1

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-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed