SCHEMBL6277489

SCHEMBL6277489

Cc1ccc(C2=NNC(C)(c3ccc(C)o3)S2)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ MAPT P10636 4/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ ADAMTS5 Q9UNA0 14/20 0.41
▸ HPGD P15428 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ RAB9A P51151 1/20 0.33
▸ ADAMTS4 O75173 1/20 0.32

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
SCHEMBL6276478 0.89 ADAMTS5 (0.40) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6272523 0.77 HTR2B (0.35) ALDH1A1MAPTKDM4EGAAHPGD
SCHEMBL6274808 0.77 ADAMTS5 (0.41) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6277691 0.74 ADAMTS5 (0.43) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6277484 0.74 KDM4E (0.45) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6275216 0.73 RAB9A (0.52) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6276966 0.73 ALDH1A1 (0.52) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6271657 0.72 KDM4E (0.44) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6274347 0.72 ADAMTS5 (0.47) ALDH1A1MAPTKDM4ETDP1GAA
SCHEMBL6272349 0.72 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETDP1GAA

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-2005092304-A2 ANTIFUNGAL AGENTS F2G LTD (GB) 2005-10-06 — — WO claimed
WO-2005092304-A2 ANTIFUNGAL AGENTS F2G LTD (GB) 2005-10-06 — — WO disclosed
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