SCHEMBL6606440

SCHEMBL6606440

Cc1cc(-c2cc[c]cc2)[nH]n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
RAB9A P51151 3/20 0.38
POLB P06746 1/20 0.38
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
AXL P30530 1/20 0.37
KEAP1 Q14145 1/20 0.37
MAPK1 P28482 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
MITF O75030 1/20 0.36
TP53 P04637 1/20 0.36
DYRK1A Q13627 1/20 0.36
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
GFER P55789 1/20 0.34
TNIK Q9UKE5 1/20 0.33

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
SCHEMBL14069232 0.79 SMN1; SMN2 (0.66) SMN1; SMN2RAB9APOLBNPC1MAPT
SCHEMBL6972677 0.78 RAB9A (0.38) SMN1; SMN2RAB9APOLBNPC1MAPT
SCHEMBL3464281 0.78 PDPK1 (0.47) SMN1; SMN2RAB9APOLBNPC1MAPT
SCHEMBL3228033 0.76 MEN1 (0.61) SMN1; SMN2RAB9ANPC1MAPTAXL
SCHEMBL21346072 0.76 TNIK (0.54) SMN1; SMN2MAPK1TNIKAPP
SCHEMBL3070625 0.76 TRPM8 (0.62) SMN1; SMN2RAB9APOLBNPC1MAPT
SCHEMBL4893890 0.76 RAB9A (0.57) SMN1; SMN2RAB9APOLBNPC1MAPT
SCHEMBL13514605 0.76 SMN1; SMN2 (0.47) SMN1; SMN2RAB9APOLBNPC1MAPT
SCHEMBL27883363 0.76 SMN1; SMN2 (0.56) SMN1; SMN2RAB9ANPC1MAPTAXL
SCHEMBL28282909 0.76 RAB9A (0.57) SMN1; SMN2RAB9APOLBNPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP claimed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 WO claimed
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP disclosed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 WO disclosed