SCHEMBL7817162

SCHEMBL7817162

CCOC(=O)c1c(C(O)c2cc(OCOC)ccc2[N+](=O)[O-])nnn1Cc1ccc(OC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.39
POLB P06746 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MAPT P10636 3/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
PTGER4 P35408 1/20 0.36
MAOB P27338 2/20 0.35
P2RY12 Q9H244 1/20 0.35
KDM4E B2RXH2 1/20 0.35
RECQL P46063 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
AKR1C3 P42330 3/20 0.34

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
SCHEMBL7827496 0.94 MAPT (0.39) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL7824948 0.93 MAOB (0.43) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL7823440 0.90 UCHL1 (0.41) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL8073495 0.90 UCHL1 (0.38) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL7827030 0.88 UCHL1 (0.42) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL7825905 0.87 SLC5A1 (0.41) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL5515660 0.87 UCHL1 (0.41) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL7816227 0.87 UCHL1 (0.42) UCHL1POLBRXFP1MAPTALDH1A1
SCHEMBL7827679 0.85 UCHL1 (0.40) UCHL1POLBRXFP1MAPTKMT2A
SCHEMBL7827515 0.85 KMT2A (0.42) UCHL1POLBRXFP1MAPTKMT2A

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-0686636-B1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA CO (JP) 2001-04-04 EP disclosed
US-5840895-A INTERMEDIATES FOR ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1998-11-24 US disclosed
US-5686442-A ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-11-11 US disclosed