SCHEMBL6265252

SCHEMBL6265252

Cc1ccnc(C2(C)NN=C(c3ccccc3)S2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 13/20 0.46
▸ MEN1 O00255 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ MDM2 Q00987 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SLC27A2 O14975 1/20 0.36
▸ KDR P35968 2/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34

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
SCHEMBL6266093 0.83 ADAMTS5 (0.40) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6265491 0.80 ADAMTS5 (0.45) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6264285 0.76 ADAMTS5 (0.43) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6276393 0.75 ADAMTS5 (0.44) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6274347 0.73 ADAMTS5 (0.47) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6264046 0.73 ALDH1A1 (0.41) ADAMTS5ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6262704 0.73 ADAMTS5 (0.49) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6265246 0.72 ADAMTS5 (0.42) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6262667 0.71 HTT (0.38) ADAMTS5MEN1ALDH1A1KMT2ALMNA
SCHEMBL6266369 0.70 ADAMTS5 (0.39) ADAMTS5MEN1ALDH1A1KMT2ALMNA

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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