SCHEMBL8978262

SCHEMBL8978262

CC(CC(=O)OCc1ccccc1)NC(N)=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 2/20 0.53
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MMP9 P14780 1/20 0.50
POLB P06746 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ATM Q13315 1/20 0.46
CTSL P07711 1/20 0.45
CTSS P25774 1/20 0.45
ABCB1 P08183 1/20 0.44
CTSK P43235 2/20 0.44

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
Hydrochloric Acid SCHEMBL7373363 0.85 SLC15A1 (0.50) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9
SCHEMBL9214937 0.85 SLC15A1 (0.50) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9
SCHEMBL14195227 0.83 ALDH1A1 (0.54) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9
SCHEMBL14194794 0.81 SLC15A1 (0.58) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9
SCHEMBL75663 0.81 KLK5 (0.55) SLC15A1MMP9ATMCTSLCTSS
SCHEMBL8972541 0.81 KLK5 (0.55) SLC15A1MMP9ATMCTSLCTSS
SCHEMBL25594543 0.81 ALDH1A1 (0.51) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9
SCHEMBL2902518 0.80 ATM (0.53) NPC1RAB9AATMCTSLCTSS
SCHEMBL84418 0.80 SLC15A1 (0.63) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9
SCHEMBL7207073 0.80 SLC15A1 (0.63) SLC15A1ALDH1A1MAPK1L3MBTL1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0378930-B1 Cyclic urea derivative NIPPON PAINT CO LTD (JP) 1996-05-08 EP disclosed
US-5385985-A Cyclic urea derivative NIPPON PAINT CO., LTD. (JP) 1995-01-31 US disclosed
EP-0378930-A1 Cyclic urea derivative NIPPON PAINT CO., LTD. (JP) 1990-07-25 EP disclosed