SCHEMBL30520983

SCHEMBL30520983

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

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 5/20 0.49
▸ MAX P61244 4/20 0.49
▸ MEN1 O00255 5/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ AGTR1 P30556 1/20 0.34
▸ IDO1 P14902 1/20 0.33
▸ CFTR P13569 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ POLB P06746 2/20 0.31
▸ GSTP1 P09211 2/20 0.31
▸ GSTM2 P28161 2/20 0.31
▸ RECQL P46063 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ ABCG2 Q9UNQ0 2/20 0.30

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
SCHEMBL25340340 1.00 MYC (0.49) MYCMAXMEN1KMT2ARXFP1
SCHEMBL25342181 0.94 MYC (0.42) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL30520985 0.94 MYC (0.42) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL30521406 0.93 MYC (0.46) MYCMAXMEN1KMT2ARXFP1
SCHEMBL25342461 0.93 MYC (0.46) MYCMAXMEN1KMT2ARXFP1
SCHEMBL25343211 0.93 MYC (0.49) MYCMAXMEN1KMT2ARXFP1
SCHEMBL30521029 0.93 MYC (0.49) MYCMAXMEN1KMT2ARXFP1
SCHEMBL25342711 0.92 MYC (0.38) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL30521124 0.92 MYC (0.38) MYCMAXMEN1KMT2AALDH1A1
SCHEMBL25343139 0.90 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
Send feedback