SCHEMBL2365010

SCHEMBL2365010

CCC(NC(C)=O)(C(=O)O)c1ccccc1Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.50
NPSR1 Q6W5P4 1/20 0.50
POLB P06746 3/20 0.41
ATM Q13315 2/20 0.41
TSPO P30536 1/20 0.40
MMP2 P08253 1/20 0.39
MMP13 P45452 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ADRA2C P18825 1/20 0.39
GAA P10253 1/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
CTNNB1 P35222 1/20 0.38
ALDH1A1 P00352 2/20 0.37
RECQL P46063 1/20 0.37
MAPK8 P45983 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
RIPK1 Q13546 1/20 0.37
RAB9A P51151 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
SCHEMBL2364635 0.86 KMT2A (0.49) POLBATMMEN1KMT2AGAA
SCHEMBL2364591 0.77 NFE2L2 (0.41) POLBATMMEN1KMT2AGAA
SCHEMBL2364652 0.77 ALDH1A1 (0.38) POLBMEN1KMT2AADRA2CLMNA
SCHEMBL9829581 0.75 CXCR2 (0.42) L3MBTL1KMT2ALMNAMAPTALDH1A1
SCHEMBL9829583 0.75 CXCR2 (0.42) L3MBTL1KMT2ALMNAMAPTALDH1A1
SCHEMBL2364807 0.73 ALDH1A1 (0.37) POLBATMMEN1KMT2AGAA
SCHEMBL3745836 0.73 L3MBTL1 (0.50) L3MBTL1NPSR1POLBATMTSPO
SCHEMBL2364868 0.72 KMT2A (0.38) L3MBTL1POLBMEN1KMT2AGAA
SCHEMBL12585668 0.71 CTNNB1 (0.47) L3MBTL1NPSR1POLBATMTSPO
SCHEMBL9482735 0.70 L3MBTL1 (0.50) L3MBTL1NPSR1POLBATMTSPO

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
WO-2011092284-A1 NOVEL AMINO ACID DERIVATIVES AND THEIR USE AS GPR43 RECEPTOR MODULATORS EUROSCREEN S.A. (BE) 2011-08-04 WO disclosed