SCHEMBL3395413

SCHEMBL3395413

Cc1c(Br)cnc2cccnc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 3/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ KDM4E B2RXH2 4/20 0.42
▸ PRMT5 O14744 1/20 0.40
▸ CCR1 P32246 4/20 0.37
▸ CCR8 P51685 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ HTT P42858 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ CCR5 P51681 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ TP53 P04637 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ USP2 O75604 2/20 0.37
▸ APAF1 O14727 1/20 0.37
▸ TDP2 O95551 1/20 0.37
▸ CASP3 P42574 1/20 0.37

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
SCHEMBL18266935 0.80 L3MBTL1 (0.48) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL31330058 0.80 KDM4E (0.44) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL13309958 0.77 HTT (0.46) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL22595963 0.77 PRMT5 (0.47) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL23763083 0.77 HSP90AA1 (0.45) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL14036115 0.77 KDM4E (0.39) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL22792743 0.74 HSP90AA1 (0.42) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL3151475 0.74 PDGFRB (0.43) HSP90AA1L3MBTL1NPC1KDM4EPRMT5
SCHEMBL26920348 0.74 ADRA2A (0.45) HSP90AA1L3MBTL1NPC1KDM4ECCR1
SCHEMBL16541494 0.73 NPC1 (0.41) HSP90AA1L3MBTL1NPC1KDM4EPRMT5

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
EP-2233493-A1 Macrolides Pfizer Products Inc. (US) 2010-09-29 — — EP disclosed
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