SCHEMBL11545877

SCHEMBL11545877

Cc1ccc(S(=O)(=O)N2CCC2)cc1-c1cccnc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
POLB P06746 1/20 0.57
RECQL P46063 1/20 0.57
CTDSP1 Q9GZU7 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
ALDH1A1 P00352 8/20 0.55
PKM P14618 1/20 0.55
MAPK1 P28482 1/20 0.54
NPSR1 Q6W5P4 6/20 0.50
USP2 O75604 4/20 0.50
HPGD P15428 3/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 2/20 0.50
TSHR P16473 2/20 0.50
GAA P10253 1/20 0.50
GFER P55789 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LMNA P02545 3/20 0.49
PIK3CD O00329 2/20 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
SCHEMBL11021281 0.83 NAPRT (0.53) MAPTTDP1ALDH1A1KDM4ELMNA
SCHEMBL11545880 0.78 KDM4E (0.53) MAPTALDH1A1MAPK1USP2HPGD
SCHEMBL28882091 0.77 ALDH1A1 (0.69) MAPTPOLBALDH1A1PKMMAPK1
SCHEMBL30058951 0.76 ALDH1A1 (0.68) MAPTALDH1A1PKMMAPK1NPSR1
SCHEMBL27331342 0.75 KDM4E (0.64) MAPTPOLBALDH1A1MAPK1NPSR1
SCHEMBL28859929 0.72 HPGD (0.66) MAPTPOLBALDH1A1MAPK1NPSR1
SCHEMBL16055320 0.72 ALDH1A1 (0.49) MAPTALDH1A1PKMNPSR1MEN1
SCHEMBL27083786 0.70 HPGD (0.68) MAPTPOLBALDH1A1MAPK1NPSR1
SCHEMBL8306889 0.70 RXFP1 (0.58) MAPTPOLBRECQLCTDSP1TDP1
SCHEMBL14003400 0.70 CYP2A6 (0.54) MAPTTDP1ALDH1A1HPGDKDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4163855-A Azetidine compounds and process for production PHILIP MORRIS INCORPORATED (US) 1979-08-07 US disclosed
US-4163856-A Azetidine compounds and process for production PHILIP MORRIS INCORPORATED (US) 1979-08-07 US disclosed