SCHEMBL9548072

SCHEMBL9548072

CCNC(=N)Nc1nc(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)s1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.63
ALDH1A1 P00352 4/20 0.63
KDM4E B2RXH2 3/20 0.63
GAA P10253 3/20 0.63
LMNA P02545 3/20 0.63
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
PTGS2 P35354 4/20 0.56
RECQL P46063 2/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
THRB P10828 1/20 0.51
USP2 O75604 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ABL1 P00519 1/20 0.47
ACHE P22303 4/20 0.46
ADORA3 P0DMS8 1/20 0.45

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
SCHEMBL9548090 0.86 MAPT (0.68) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL9548024 0.82 MAPT (0.63) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL9548102 0.82 MAPT (0.69) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL6285228 0.80 MAPT (0.63) MAPTALDH1A1KDM4EGAALMNA
Hydrochloric Acid SCHEMBL9547998 0.79 MAPT (0.68) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL9548088 0.78 MAPT (0.57) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL9548112 0.78 MAPT (0.60) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL6546188 0.78 MAPT (0.60) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL9548033 0.76 MAPT (0.69) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL9547985 0.75 MAPT (0.68) MAPTALDH1A1KDM4EGAALMNA

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-5217971-A Anticoagulants, hypotensive agents, antiallergens and antiinflammatory agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-08 US disclosed
EP-0377457-A1 Thiazole compounds, processes for the preparation thereof, and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-07-11 EP disclosed