SCHEMBL6277257

SCHEMBL6277257

c1ccc(C2=NNC(c3ccccc3)(c3ccccc3)S2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 18/20 0.58
▸ SLC27A2 O14975 1/20 0.51
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ LMNA P02545 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ HPGD P15428 2/20 0.48
▸ XBP1 P17861 1/20 0.48
▸ MDM2 Q00987 1/20 0.48
▸ MMP12 P39900 1/20 0.38
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KDM4E B2RXH2 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
SCHEMBL6274593 0.81 ADAMTS5 (0.54) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL6276393 0.78 ADAMTS5 (0.44) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL6276626 0.78 ADAMTS5 (0.51) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL4201238 0.74 ADAMTS5 (1.00) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL6277508 0.74 ADAMTS5 (0.44) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL6275130 0.73 ADAMTS5 (0.57) ADAMTS5MEN1KMT2AALDH1A1LMNA
SCHEMBL6265246 0.72 ADAMTS5 (0.42) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL6274590 0.71 ADAMTS5 (0.42) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL6277477 0.70 ADAMTS5 (0.44) ADAMTS5SLC27A2MEN1KMT2AALDH1A1
SCHEMBL4351598 0.70 ADAMTS5 (1.00) ADAMTS5SLC27A2MEN1KMT2AALDH1A1

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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