SCHEMBL29076941

SCHEMBL29076941

[N-]=[N+]=Nc1c(-c2ccccc2)oc2ccccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.55
▸ MEN1 O00255 4/20 0.55
▸ KDM4E B2RXH2 4/20 0.55
▸ CYP3A4 P08684 4/20 0.55
▸ LMNA P02545 3/20 0.55
▸ ALOX15 P16050 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ CA1 P00915 2/20 0.55
▸ CA2 P00918 2/20 0.55
▸ TP53 P04637 2/20 0.55
▸ DDR2 Q16832 1/20 0.55
▸ CA12 O43570 1/20 0.55
▸ ABCB1 P08183 1/20 0.55
▸ CALM1 P0DP23 1/20 0.55
▸ AR P10275 1/20 0.55
▸ PKM P14618 1/20 0.55
▸ CYP1B1 Q16678 1/20 0.55
▸ CA9 Q16790 1/20 0.55
▸ ADORA3 P0DMS8 1/20 0.55
▸ ABCG2 Q9UNQ0 5/20 0.52

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
SCHEMBL29349443 0.74 KMT2A (0.69) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL693914 0.74 KMT2A (0.69) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL28847414 0.73 KMT2A (0.67) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL7703075 0.73 PLA2G2A (0.73) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL31717956 0.73 KMT2A (0.67) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL28162855 0.73 KMT2A (0.67) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL4634257 0.73 KMT2A (0.67) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL23611018 0.71 DDR2 (0.70) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL1423181 0.71 KMT2A (0.65) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL87774 0.71 ADORA3 (1.00) KMT2AMEN1KDM4ECYP3A4LMNA

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
CN-116529266-A Compositions and methods for delivering nucleic acids to cells 耶鲁大学 2023-08-01 — — CN disclosed
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