SCHEMBL14303997

SCHEMBL14303997

COc1ccc(Oc2ccc3c4c(cccc24)C(=O)OC3=O)c(N)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ MAPT P10636 4/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ THRB P10828 1/20 0.44
▸ MCL1 Q07820 4/20 0.43
▸ BCL2 P10415 3/20 0.43
▸ PRMT1 Q99873 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ PABPC1 P11940 1/20 0.42
▸ XBP1 P17861 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMARCA2 P51531 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42

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
SCHEMBL24634087 0.82 KMT2A (0.43) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL29886848 0.82 KMT2A (0.43) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL24633993 0.82 TYMS (0.43) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL16684611 0.81 TYMS (0.47) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL30557400 0.81 TYMS (0.47) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL14304001 0.81 ALDH1A1 (0.48) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL29875713 0.80 L3MBTL1 (0.48) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL17439429 0.78 ANPEP (0.48) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL29875769 0.78 KMT2A (0.39) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL6548245 0.78 KMT2A (0.76) KMT2AMEN1POLBMAPTALDH1A1

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-2008001036-A2 COMPOUND, COMPOSITION AND USE FUJIFILM IMAGING COLORANTS LIMITED (GB) 2008-01-03 — — WO disclosed
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