SCHEMBL6243465

SCHEMBL6243465

CCOc1ccc(C(=O)Nc2ccc(CO)cc2)cc1Br

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.77
▸ MEN1 O00255 5/20 0.77
▸ KMT2A Q03164 5/20 0.77
▸ SMN1; SMN2 Q16637 4/20 0.75
▸ KDM4E B2RXH2 2/20 0.75
▸ HTT P42858 1/20 0.75
▸ HSD17B10 Q99714 2/20 0.65
▸ ALOX15 P16050 1/20 0.65
▸ ALOX12 P18054 1/20 0.65
▸ NR4A1 P22736 1/20 0.65
▸ TP53 P04637 3/20 0.65
▸ NPC1 O15118 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ LMNA P02545 3/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ HPSE Q9Y251 6/20 0.59
▸ RAB9A P51151 1/20 0.58
▸ POLB P06746 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58

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
SCHEMBL6244283 0.88 MAPT (0.83) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6503866 0.87 KMT2A (0.74) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6245267 0.86 MAPT (0.76) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6244997 0.85 MAPT (0.74) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL10018556 0.80 KMT2A (0.74) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL13856442 0.79 MAPT (1.00) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6263727 0.78 HPSE (0.74) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL4020386 0.78 MAPT (0.59) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL14096539 0.76 MAPT (0.61) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6293914 0.76 MAPT (0.68) MAPTMEN1KMT2ASMN1; SMN2KDM4E

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-2005030206-A1 ARYL-1,3-AZOLE DERIVATIVES AND METHODS FOR INHIBITING HEPARNASE ACTIVITY IMCLONE SYSTEMS INCORPORATED (US) 2005-04-07 — — WO disclosed
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