SCHEMBL25342114

SCHEMBL25342114

O=C1c2ccccc2C(F)C(=O)N1CCOCCOCC(=O)N(c1ccc(F)cc1)c1ccc([N+](=O)[O-])c2nonc12

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 7/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ IDO1 P14902 3/20 0.33
▸ TDO2 P48775 2/20 0.33
▸ MAX P61244 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 1/20 0.31
▸ GSTP1 P09211 1/20 0.31
▸ GSTM2 P28161 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ RECQL P46063 1/20 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
SCHEMBL30520833 1.00 MYC (0.35) MYCMEN1KMT2AIDO1TDO2
SCHEMBL25343359 0.92 MEN1 (0.36) MYCMEN1KMT2AIDO1TDO2
SCHEMBL30520996 0.92 MEN1 (0.36) MYCMEN1KMT2AIDO1TDO2
SCHEMBL30521037 0.90 MYC (0.33) MYCMEN1KMT2AIDO1TDO2
SCHEMBL25339888 0.90 MYC (0.33) MYCMEN1KMT2AIDO1TDO2
SCHEMBL25345199 0.89 GSTP1 (0.34) MYCMEN1KMT2AMAXALDH1A1
SCHEMBL30521540 0.89 GSTP1 (0.34) MYCMEN1KMT2AMAXALDH1A1
SCHEMBL25342557 0.89 IDO1 (0.34) MYCMEN1KMT2AIDO1TDO2
SCHEMBL30520753 0.89 IDO1 (0.34) MYCMEN1KMT2AIDO1TDO2
SCHEMBL25342711 0.88 MYC (0.38) MYCMEN1KMT2AMAXALDH1A1

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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