SCHEMBL6275130

SCHEMBL6275130

Cc1ccc(C2=NNC(c3ccccc3)(c3ccccc3C=O)S2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 19/20 0.57
▸ ALDH1A1 P00352 3/20 0.44
▸ LMNA P02545 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ ADAMTS4 O75173 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ XBP1 P17861 1/20 0.40
▸ MDM2 Q00987 1/20 0.40

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
SCHEMBL6274593 0.91 ADAMTS5 (0.54) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6277257 0.73 ADAMTS5 (0.58) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL4351836 0.73 ADAMTS5 (1.00) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6262704 0.71 ADAMTS5 (0.49) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL4192767 0.70 ADAMTS5 (1.00) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6265250 0.67 ADAMTS5 (0.45) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6275124 0.67 ADAMTS5 (0.45) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6274347 0.66 ADAMTS5 (0.47) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL4343954 0.66 ADAMTS5 (1.00) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL15928247 0.65 ADAMTS5 (0.78) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT

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

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