SCHEMBL4747979

SCHEMBL4747979

O=C(Nc1ccccc1Cl)c1cc2ccccc2c(/N=N/c2ccc(-c3nc4ccc(/N=N/c5c(O)c(C(=O)Nc6ccccc6Cl)cc6ccccc56)cc4o3)cc2)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.50
▸ TP53 P04637 5/20 0.47
▸ NQO2 P16083 1/20 0.45
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ THRB P10828 2/20 0.42
▸ POLB P06746 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL4747982 1.00 MAPT (0.50) MAPTTP53NQO2MEN1KMT2A
SCHEMBL11913164 0.88 NQO2 (0.59) MAPTTP53NQO2MEN1KMT2A
SCHEMBL10413849 0.88 NQO2 (0.49) MAPTTP53NQO2MEN1KMT2A
SCHEMBL19827077 0.81 KDM4E (0.46) MAPTNQO2MEN1KMT2ANPC1
SCHEMBL14565032 0.80 NQO2 (0.57) MAPTNQO2MEN1KMT2ANPC1
SCHEMBL12228818 0.77 NQO2 (0.49) MAPTNQO2MEN1KMT2ANPC1
SCHEMBL713606 0.77 NQO2 (0.49) MAPTNQO2MEN1KMT2ANPC1
SCHEMBL5029442 0.77 NQO2 (0.49) MAPTNQO2MEN1KMT2ANPC1
SCHEMBL11911556 0.77 KMT2A (0.39) MAPTTP53NQO2MEN1KMT2A
SCHEMBL13586835 0.77 NQO2 (0.53) MAPTNQO2MEN1KMT2ANPC1

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-2008133617-A1 PHOTOCONDUCTOR HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2008-11-06 — — WO disclosed
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