SCHEMBL11247841

SCHEMBL11247841

CNCc1oc(CSCCN)cc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.39
CYP1A2 P05177 3/20 0.34
CYP2C19 P33261 3/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2D6 P10635 2/20 0.33
KCNA3 P22001 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
SOS1 Q07889 1/20 0.32
APEX1 P27695 1/20 0.31
ATR Q13535 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL11244950 0.78 PRMT6 (0.41) PRMT6APEX1
SCHEMBL11247991 0.77 KIF11 (0.40) PRMT6HSD17B10APEX1KDM4EALDH1A1
SCHEMBL11254954 0.75 ACHE (0.56) CYP2C19HSD17B10MEN1ALDH1A1MAPT
SCHEMBL11254944 0.75 ACHE (0.56) CYP2C19HSD17B10MEN1ALDH1A1MAPT
SCHEMBL10741444 0.71 PRMT6 (0.61) PRMT6SOS1
SCHEMBL11460057 0.70 PRMT6 (0.38) PRMT6
SCHEMBL9870480 0.64 CYP1A2 (0.46) PRMT6CYP1A2CYP2C19CYP2D6CYP3A4
SCHEMBL10846891 0.63 PRMT6 (0.50) PRMT6CYP1A2CYP2C19CYP2D6CYP3A4
SCHEMBL10743295 0.62 PRMT6 (0.47) PRMT6CYP1A2CYP2C19CYP2D6CYP3A4
Dimethylamine SCHEMBL9365842 0.62 PRMT6 (0.57) PRMT6CYP1A2CYP2C19HSD17B10CYP2D6

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-0001699-B1 DERIVATIVES OF FURYL COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 1982-02-24 EP disclosed
US-4288443-A HISTAMINE ANTAGONISTS GLAXO GROUP LIMITED (GB) 1981-09-08 US disclosed
EP-0001699-A2 Derivatives of furyl compounds, their preparation and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1979-05-02 EP disclosed