SCHEMBL2363609

SCHEMBL2363609

CNC(=O)c1ccc(N2N=C(C)C(=Cc3ccc(-c4cc(C)c(C)cc4[N+](=O)[O-])o3)C2=O)cc1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 17/20 0.83
▸ CREBBP Q92793 1/20 0.83
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ USP2 O75604 1/20 0.58
▸ POLB P06746 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ RAB9A P51151 1/20 0.56
▸ GPR55 Q9Y2T6 1/20 0.53

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
SCHEMBL14999167 1.00 EP300 (0.83) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL29441235 0.91 EP300 (1.00) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL14991292 0.91 EP300 (1.00) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL12092858 0.91 EP300 (1.00) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL29711734 0.91 EP300 (1.00) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL14991291 0.91 EP300 (1.00) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL26157789 0.91 EP300 (0.87) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL14991408 0.90 EP300 (0.83) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL14991407 0.90 EP300 (0.83) EP300CREBBPMEN1KMT2AUSP2
SCHEMBL15003843 0.90 EP300 (0.83) EP300CREBBPMEN1KMT2AUSP2

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-2011085039-A2 USE OF HISTONE ACETYLTRANSFERASE INHIBITORS AS NOVEL ANTI-CANCER THERAPIES THE JOHNS HOPKINS UNIVERSITY (US) 2011-07-14 — — WO disclosed
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