SCHEMBL8580260

SCHEMBL8580260

C[C@H](NC(=O)c1ccccn1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.66
KDM4E B2RXH2 3/20 0.58
HTT P42858 2/20 0.58
ALDH1A1 P00352 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
ALPL P05186 1/20 0.52
LMNA P02545 2/20 0.52
NAPRT Q6XQN6 1/20 0.52
P4HTM Q9NXG6 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
OPRK1 P41145 1/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
TLR7 Q9NYK1 1/20 0.50
PTGS2 P35354 1/20 0.50
GFER P55789 1/20 0.50
EPHX2 P34913 1/20 0.50
BBOX1 O75936 2/20 0.49
EGLN1 Q9GZT9 2/20 0.49

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
SCHEMBL8580257 1.00 KDM4C (0.66) KDM4CKDM4EHTTALDH1A1SMN1; SMN2
SCHEMBL1106971 0.84 KDM4E (0.63) KDM4EHTTALDH1A1SMN1; SMN2TDP1
SCHEMBL28674012 0.84 KDM4E (0.55) KDM4CKDM4EHTTALDH1A1SMN1; SMN2
SCHEMBL8581979 0.84 KDM4E (0.55) KDM4CKDM4EHTTALDH1A1SMN1; SMN2
SCHEMBL8581974 0.84 KDM4E (0.55) KDM4CKDM4EHTTALDH1A1SMN1; SMN2
SCHEMBL27553175 0.83 ALDH1A1 (0.61) KDM4EHTTALDH1A1SMN1; SMN2TDP1
SCHEMBL27883403 0.83 KDM4E (0.54) KDM4CKDM4EHTTALDH1A1SMN1; SMN2
SCHEMBL24568670 0.81 ALDH1A1 (0.59) KDM4EHTTALDH1A1SMN1; SMN2TDP1
SCHEMBL22618857 0.81 ALDH1A1 (0.59) KDM4EHTTALDH1A1SMN1; SMN2TDP1
SCHEMBL16164864 0.80 GSK3B (0.54) KDM4EHTTALDH1A1SMN1; SMN2TDP1

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
US-5756650-A COMPOSITION COMPRISING POLYAMIC ACID, CURE ACCELERATOR SELECTED FROM GROUP CONSISTING OF NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AMINO ACID COMPOUND, AROMATIC COMPOUND HAVING TWO OR MORE HYDROXYL GROUPS KABUSHIKI KAISHA TOSHIBA (JP) 1998-05-26 US disclosed