SCHEMBL20207726

SCHEMBL20207726

CCCCOC1CCN(S(C)(=O)=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.39
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP2D6 P10635 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
HRH2 P25021 1/20 0.37
HRH1 P35367 1/20 0.37
TSHR P16473 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MAPK1 P28482 1/20 0.35
RECQL P46063 1/20 0.35
LIPC P11150 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
SMN1; SMN2 Q16637 1/20 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
SCHEMBL20201444 0.90 LIPC (0.38) TP53L3MBTL1HTTTDP1POLB
SCHEMBL24571585 0.82 HRH2 (0.40) L3MBTL1HTTLMNAALDH1A1HRH3
SCHEMBL14670935 0.82 L3MBTL1 (0.47) TP53L3MBTL1HTTTDP1LMNA
SCHEMBL20201457 0.81 GAA (0.42) L3MBTL1LMNAALDH1A1TSHRMAPK1
SCHEMBL578343 0.81 TP53 (0.46) TP53L3MBTL1HTTLMNANPC1
SCHEMBL22592558 0.79 TP53 (0.38) TP53L3MBTL1HTTLMNANPC1
SCHEMBL24572108 0.78 HRH2 (0.40) ALDH1A1HRH3HRH2HRH1TSHR
SCHEMBL771543 0.77 TP53 (0.44) TP53L3MBTL1HTTTDP1POLB
SCHEMBL6603236 0.76 GNAI3 (0.43) TP53NPC1RAB9ACYP2D6HRH3
SCHEMBL6603242 0.76 GNAI3 (0.43) TP53NPC1RAB9ACYP2D6HRH3

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
WO-2018128720-A1 URACIL CONTAINING COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-07-12 WO disclosed
WO-2018098207-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed