SCHEMBL6271575

SCHEMBL6271575

CC1(c2ccccn2)NN=C(c2ccc(Cl)cc2)S1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 8/20 0.35
▸ MECP2 P51608 1/20 0.34
▸ MBD2 Q9UBB5 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ TLR7 Q9NYK1 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ CYP19A1 P11511 1/20 0.31
▸ BACE1 P56817 2/20 0.31
▸ CACNA1B Q00975 1/20 0.31

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 0.89 ADAMTS5 (0.40) ADAMTS5L3MBTL1KDM4EALDH1A1GAA
SCHEMBL6265491 0.88 ADAMTS5 (0.45) ADAMTS5L3MBTL1KDM4EALDH1A1GAA
SCHEMBL6268159 0.80 RAB9A (0.39) L3MBTL1KDM4EALDH1A1GAAMAPT
SCHEMBL6260436 0.77 MECP2 (0.47) ADAMTS5MECP2MBD2L3MBTL1KDM4E
SCHEMBL6268735 0.76 GCGR (0.39) ADAMTS5KDM4EALDH1A1GAAMAPT
SCHEMBL6278069 0.75 NPC1 (0.38) ADAMTS5ALDH1A1CYP19A1
SCHEMBL6260546 0.74 ADAMTS5 (0.36) ADAMTS5MECP2MBD2L3MBTL1KDM4E
SCHEMBL6265204 0.74 ADAMTS5 (0.37) ADAMTS5L3MBTL1ALDH1A1MAPTTDP1
SCHEMBL6271657 0.73 KDM4E (0.44) ADAMTS5L3MBTL1KDM4EALDH1A1GAA
SCHEMBL6278562 0.73 ADAMTS5 (0.35) ADAMTS5MECP2MBD2L3MBTL1KDM4E

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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