SCHEMBL27993299

SCHEMBL27993299

Cc1nn(-c2cccc(C(=O)O)c2)c(C)c1C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.67
ALDH1A1 P00352 5/20 0.54
POLB P06746 4/20 0.54
KDM4E B2RXH2 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
GAA P10253 2/20 0.54
HSD17B10 Q99714 2/20 0.54
USP2 O75604 1/20 0.54
MYC P01106 1/20 0.54
HSPA1A P0DMV8 1/20 0.54
MAPT P10636 1/20 0.54
ALOX15 P16050 1/20 0.54
NR4A1 P22736 1/20 0.54
PTPN7 P35236 1/20 0.54
RECQL P46063 1/20 0.54
BLM P54132 1/20 0.54
APEX1 P27695 2/20 0.48
CTDSP1 Q9GZU7 1/20 0.48

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
SCHEMBL21935952 0.85 MEN1 (0.69) L3MBTL1ALDH1A1POLBKDM4EMEN1
SCHEMBL13326698 0.84 TP53 (0.52) L3MBTL1ALDH1A1POLBKDM4ETDP1
SCHEMBL21935961 0.83 L3MBTL1 (0.62) L3MBTL1ALDH1A1POLBKDM4EMEN1
SCHEMBL30388882 0.82 L3MBTL1 (0.60) L3MBTL1ALDH1A1POLBKDM4EMEN1
SCHEMBL21879580 0.82 L3MBTL1 (0.60) L3MBTL1ALDH1A1POLBKDM4EMEN1
SCHEMBL20502220 0.79 PDE4D (0.74) L3MBTL1ALDH1A1MEN1KMT2AMAPT
SCHEMBL15362559 0.78 CYP1A2 (0.64) L3MBTL1ALDH1A1POLBKDM4EMEN1
SCHEMBL16962934 0.78 SMN1; SMN2 (0.45) L3MBTL1ALDH1A1POLBKDM4ETDP1
SCHEMBL3015820 0.77 L3MBTL1 (0.55) L3MBTL1ALDH1A1POLBKDM4EMEN1
SCHEMBL16554846 0.77 L3MBTL1 (0.59) L3MBTL1ALDH1A1POLBKDM4EMEN1

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
CN-104661661-A External liquid preparation for resisting trichophytosis MEIJI SEIKA PHARMA CO LTD 2015-05-27 CN disclosed