SCHEMBL30521406

SCHEMBL30521406

COC(=O)c1ccc(N(C(=O)COCCOCCN2C(=O)c3ccccc3C(F)C2=O)c2ccc([N+](=O)[O-])c3nonc23)c(-c2ccc(C(C)(C)C)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 4/20 0.46
▸ MAX P61244 3/20 0.46
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ CFTR P13569 1/20 0.31

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
SCHEMBL25342461 1.00 MYC (0.46) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL25340340 0.93 MYC (0.49) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL30520983 0.93 MYC (0.49) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL30520985 0.88 MYC (0.42) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL25342181 0.88 MYC (0.42) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL25343211 0.87 MYC (0.49) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL30521029 0.87 MYC (0.49) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL25342711 0.85 MYC (0.38) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL30521124 0.85 MYC (0.38) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL25343139 0.83 MYC (0.37) MYCMAXMEN1KMT2AALDH1A1

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-2023143494-A1 NEW PROTAC COMPOUND 甘李药业股份有限公司 2023-08-03 — — WO disclosed
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