SCHEMBL6060740

SCHEMBL6060740

CCN(CC)c1ccccc1-c1ccccc1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
HSD17B10 Q99714 2/20 0.40
RECQL P46063 2/20 0.38
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
PSMD14 O00487 1/20 0.38
MAPK1 P28482 1/20 0.38
GFER P55789 1/20 0.38
S100B P04271 1/20 0.36
IDO1 P14902 1/20 0.35
GAA P10253 4/20 0.35
MAPT P10636 4/20 0.35
RAB9A P51151 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 2/20 0.35

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
SCHEMBL50190 0.83 ALDH1A1 (0.43) ALDH1A1L3MBTL1HSD17B10RECQLCYP3A4
Hydrochloric Acid SCHEMBL6639005 0.81 ALDH1A1 (0.41) ALDH1A1L3MBTL1HSD17B10RECQLCYP3A4
Hydrochloric Acid SCHEMBL6480110 0.81 ALDH1A1 (0.41) ALDH1A1L3MBTL1HSD17B10RECQLCYP3A4
SCHEMBL10437517 0.78 CYP3A4 (0.38) ALDH1A1CYP3A4TSHRGAAMAPT
SCHEMBL3792075 0.77 ALDH1A1 (0.59) ALDH1A1L3MBTL1HSD17B10CYP3A4TSHR
SCHEMBL6711035 0.77 ALDH1A1 (0.32) ALDH1A1L3MBTL1RECQLCYP3A4TSHR
SCHEMBL2491518 0.76 RAB9A (0.35) ALDH1A1L3MBTL1RECQLTSHRTDP1
SCHEMBL28125398 0.76 MEN1 (0.42) ALDH1A1L3MBTL1HSD17B10RECQLTSHR
SCHEMBL10700706 0.75 ALDH1A1 (0.44) ALDH1A1L3MBTL1HSD17B10RECQLCYP3A4
SCHEMBL4817859 0.75 NR3C1 (0.46) ALDH1A1L3MBTL1HSD17B10TSHRMAPK1

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-1401297-B1 MICROBIOLOGICAL CONTROL IN POULTRY PROCESSING ALBEMARLE CORP (US) 2006-08-23 EP disclosed