SCHEMBL8656365

SCHEMBL8656365

[c]1ncc(N2CCCC2)c(N2CCCC2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
ALDH1A1 P00352 6/20 0.35
MAPK1 P28482 4/20 0.35
TSHR P16473 3/20 0.35
KDM4E B2RXH2 3/20 0.35
GFER P55789 2/20 0.35
MAPT P10636 2/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 4/20 0.34
KEAP1 Q14145 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 2/20 0.33

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
SCHEMBL15415347 1.00 HPGD (0.39) HPGDALDH1A1MAPK1TSHRKDM4E
SCHEMBL15415930 0.81 SMN1; SMN2 (0.40) HPGDALDH1A1MAPK1TSHRKDM4E
SCHEMBL16792289 0.81 HPGD (0.37) HPGDALDH1A1MAPK1TSHRKDM4E
SCHEMBL15415897 0.81 HPGD (0.37) HPGDALDH1A1MAPK1TSHRKDM4E
SCHEMBL15539902 0.81 GAA (0.37) ALDH1A1MAPK1MAPTPOLBKEAP1
SCHEMBL15415694 0.78 MAPT (0.34) HPGDALDH1A1MAPK1TSHRKDM4E
SCHEMBL16795112 0.78 SMN1; SMN2 (0.37) HPGDALDH1A1MAPK1TSHRKDM4E
SCHEMBL15415816 0.77 DHODH (0.41) ALDH1A1KDM4EPOLBSMN1; SMN2
SCHEMBL15415841 0.77 HPGD (0.38) HPGDALDH1A1MAPK1TSHRKDM4E
SCHEMBL16792888 0.77 ALDH1A1 (0.35) HPGDALDH1A1MAPK1TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0576941-B1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO (JP) 1997-09-03 EP claimed
EP-0576941-A1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-01-05 EP claimed
US-5854250-A N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process of preparing same GYOGYSZERKUTATO INTEZET KFT (HU) 1998-12-29 US disclosed
US-5854250-A N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process of preparing same GYOGYSZERKUTATO INTEZET KFT (HU) 1998-12-29 US disclosed
US-5705529-A ANTIISCHEMIC AGENTS, ANTIINFLAMMATORY AGENTS, AGING RESISTANCE, ATHERIOSCLEROSIS, NERVOUS SYSTEM DISORDERS GYOGYSZERKUTATO INTEZET KFT (HK) 1998-01-06 US disclosed
EP-0576941-B1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO (JP) 1997-09-03 EP disclosed
EP-0576941-A1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-01-05 EP disclosed
EP-0576941-A1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-01-05 EP disclosed