SCHEMBL7016593

SCHEMBL7016593

NC(Cc1c[nH]c2c1ccc1cccnc12)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 1/20 0.55
TET1 Q8NFU7 1/20 0.55
TNF P01375 1/20 0.54
MAPT P10636 5/20 0.51
KMT2A Q03164 3/20 0.51
LMNA P02545 3/20 0.51
KDM4E B2RXH2 3/20 0.51
TSHR P16473 2/20 0.51
BLM P54132 2/20 0.51
PMP22 Q01453 2/20 0.51
MEN1 O00255 2/20 0.51
MPO P05164 1/20 0.51
HIF1A Q16665 1/20 0.51
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
HTR1A P08908 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
ALOX15 P16050 1/20 0.48
NFKB1 P19838 1/20 0.48
HTR2A P28223 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
SCHEMBL6775785 0.86 TET2 (0.48) TET2TET1TNFMAPTLMNA
SCHEMBL31369561 0.82 MAPT (0.66) TNFMAPTKMT2ALMNAKDM4E
SCHEMBL26377272 0.78 CYP1A2 (0.48) KDM4EALDH1A1ADORA3HSD17B10NLN
SCHEMBL31641352 0.77 KMT2A (0.62) TNFMAPTKMT2ALMNAKDM4E
SCHEMBL31642354 0.77 KMT2A (0.62) TNFMAPTKMT2ALMNAKDM4E
SCHEMBL7277532 0.77 KMT2A (0.62) TNFMAPTKMT2ALMNAKDM4E
SCHEMBL29406016 0.77 KMT2A (0.62) TNFMAPTKMT2ALMNAKDM4E
SCHEMBL5298198 0.77 KMT2A (0.62) TNFMAPTKMT2ALMNAKDM4E
SCHEMBL1520374 0.77 KMT2A (0.62) TNFMAPTKMT2ALMNAKDM4E
SCHEMBL30759412 0.77 KMT2A (0.62) TNFMAPTKMT2ALMNAKDM4E

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-1255757-B1 AMINO ACID DERIVATIVES AND USE THEREOF AS NEP, ACE AND ECE INHIBITORS INST NAT SANTE RECH MED (FR) 2003-06-18 EP disclosed