SCHEMBL5820022

SCHEMBL5820022

COc1ccc(N2CCCC(=O)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
HTR3E A5X5Y0 1/20 0.49
HTR3B O95264 1/20 0.49
ADRB1 P08588 1/20 0.49
HTR3A P46098 1/20 0.49
HTR3D Q70Z44 1/20 0.49
HTR3C Q8WXA8 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
MAPT P10636 8/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KMT2A Q03164 4/20 0.47
RAB9A P51151 3/20 0.47
ALDH1A1 P00352 2/20 0.47
NR4A1 P22736 1/20 0.47
MCL1 Q07820 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL9829333 0.90 POLB (0.53) POLBHTR3EHTR3BADRB1HTR3A
SCHEMBL3182863 0.87 HTR3E (0.53) POLBHTR3EHTR3BADRB1HTR3A
SCHEMBL12301330 0.83 ALOX5 (0.56) ADRB1MAPTKMT2ATSHRMEN1
SCHEMBL19545461 0.82 L3MBTL1 (0.49) POLBHTR3EHTR3BADRB1HTR3A
SCHEMBL21262494 0.81 ADRB1 (0.44) ADRB1MAPTHSD17B10KMT2ARAB9A
SCHEMBL14638126 0.80 KCNA5 (0.42) POLBMAPTKMT2AL3MBTL1KDM4E
SCHEMBL19520761 0.79 POLB (0.52) POLBHTR3EHTR3BADRB1HTR3A
SCHEMBL738227 0.79 HTR3E (0.59) POLBHTR3EHTR3BADRB1HTR3A
SCHEMBL2925759 0.78 HTR3E (0.68) POLBHTR3EHTR3BADRB1HTR3A
SCHEMBL28129519 0.78 HTR3E (0.68) POLBHTR3EHTR3BADRB1HTR3A

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
WO-2006135383-A2 INDAZOLES MYRIAD GENETICS, INC. (US) 2006-12-21 WO disclosed