SCHEMBL10746247

SCHEMBL10746247

O=C1c2cc(Oc3cccc(C#Cc4ccccc4)c3)c3ccccc3c2C(=O)N1c1ccc2c(c1)C=C2

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ HPGD P15428 2/20 0.33
▸ GRM5 P41594 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ HAO1 Q9UJM8 1/20 0.32
▸ MCHR1 Q99705 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ HSPA1A P0DMV8 1/20 0.30
▸ PABPC1 P11940 1/20 0.30
▸ MMP2 P08253 1/20 0.30
▸ MMP9 P14780 1/20 0.30

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
SCHEMBL10744958 0.81 BRD4 (0.52) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL11204754 0.79 KMT2A (0.38) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL11206464 0.79 BRD4 (0.38) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL10747850 0.74 GRM5 (0.46) KMT2AMEN1GRM5
SCHEMBL11209928 0.72 ALDH1A1 (0.42) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL11210954 0.71 KMT2A (0.40) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL10745797 0.68 SCN2A (0.42) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL6400602 0.68 BRD4 (0.56) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL19689371 0.67 BRD4 (0.58) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL9549273 0.66 KMT2A (0.58) KMT2AMEN1HTTGRM5

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
US-4675370-A Resin systems derived from benzocyclobutene-alkyne imide monomers UNIVERSITY OF DAYTON (US) 1987-06-23 — — US disclosed
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