SCHEMBL14609808

SCHEMBL14609808

CCc1cc(-c2n[nH]c(O)c2-c2cccc3ccccc23)c(O)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.60
▸ KMT2A Q03164 7/20 0.60
▸ MAPT P10636 5/20 0.53
▸ POLB P06746 1/20 0.53
▸ HSP90AA1 P07900 3/20 0.45
▸ LMNA P02545 4/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ HTT P42858 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ ATM Q13315 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PAX8 Q06710 1/20 0.40

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
SCHEMBL12046575 0.88 HSP90AA1 (0.58) MEN1KMT2AMAPTPOLBHSP90AA1
SCHEMBL12768521 0.71 MAPT (0.75) MEN1KMT2AMAPTPOLBHSP90AA1
SCHEMBL1147840 0.70 HSP90AA1 (0.46) MEN1KMT2AMAPTHSP90AA1LMNA
SCHEMBL4874667 0.70 MEN1 (0.62) MEN1KMT2AMAPTPOLBHSP90AA1
SCHEMBL14396294 0.69 MEN1 (0.54) MEN1KMT2AMAPTPOLBHSP90AA1
SCHEMBL408306 0.68 MEN1 (0.48) MEN1KMT2AMAPTPOLBHSP90AA1
SCHEMBL4884535 0.68 MEN1 (0.52) MEN1KMT2AMAPTPOLBHSP90AA1
SCHEMBL1167358 0.67 MEN1 (0.47) MEN1KMT2AMAPTPOLBHSP90AA1
SCHEMBL38661842 0.66 GPR84 (0.44) MEN1KMT2AMAPTATMKDM4E
SCHEMBL4931003 0.65 ESR1 (0.44) MEN1KMT2AMAPTLMNAALDH1A1

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-2007021966-A1 PYRAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY SYNTA PHARMACEUTICALS CORP. (US) 2007-02-22 — — WO disclosed
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