SCHEMBL10700296

SCHEMBL10700296

CON1CCC2(CCN(C(=O)c3cccnc3)CC2)C1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.57
TDP1 Q9NUW8 1/20 0.56
MAPK1 P28482 1/20 0.52
GAA P10253 1/20 0.52
ALDH1A1 P00352 3/20 0.51
LMNA P02545 2/20 0.50
PKM P14618 1/20 0.49
POLB P06746 1/20 0.48
USP2 O75604 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HTT P42858 1/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL12706342 0.83 TDP1 (0.69) TDP1MAPK1GAAALDH1A1LMNA
SCHEMBL19159686 0.83 CHRM2 (0.62) CHRM2TDP1MAPK1ALDH1A1LMNA
SCHEMBL4815797 0.78 MAPK1 (0.57) CHRM2TDP1MAPK1GAAALDH1A1
SCHEMBL4815807 0.78 MAPK1 (0.57) CHRM2TDP1MAPK1GAAALDH1A1
SCHEMBL5433598 0.77 CHRM2 (0.58) CHRM2TDP1MAPK1GAAALDH1A1
SCHEMBL5446400 0.77 CHRM2 (0.65) CHRM2MAPK1ALDH1A1LMNAPKM
SCHEMBL9763711 0.77 PKM (0.74) TDP1MAPK1ALDH1A1LMNAPKM
SCHEMBL15058202 0.76 POLB (0.60) CHRM2TDP1MAPK1ALDH1A1LMNA
SCHEMBL29995115 0.76 POLB (0.60) CHRM2TDP1MAPK1ALDH1A1LMNA
SCHEMBL21800486 0.76 CHRM2 (0.59) CHRM2TDP1MAPK1ALDH1A1LMNA

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-0273659-A1 Azaspiro compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-07-06 EP disclosed