SCHEMBL6265250

SCHEMBL6265250

Cc1ccc(C2=NNC(c3ccccc3)(C(F)(F)F)S2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 17/20 0.45
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ADAMTS4 O75173 1/20 0.35
▸ POLB P06746 1/20 0.35

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
SCHEMBL6262704 0.77 ADAMTS5 (0.49) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6274347 0.71 ADAMTS5 (0.47) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6275124 0.69 ADAMTS5 (0.45) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6276966 0.69 ALDH1A1 (0.52) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6280973 0.69 ADAMTS5 (0.48) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6274203 0.68 ALDH1A1 (0.49) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6276545 0.68 ADAMTS5 (0.43) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6275130 0.67 ADAMTS5 (0.57) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6276393 0.66 ADAMTS5 (0.44) ADAMTS5KDM4EALDH1A1MAPTTDP1
SCHEMBL6263287 0.66 ADAMTS5 (0.42) ADAMTS5KDM4EALDH1A1MAPTTDP1

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
Send feedback