SCHEMBL25387279

SCHEMBL25387279

O=C(CCNC(=O)c1cccc2ccccc12)Nc1ccccc1Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.55
▸ L3MBTL1 Q9Y468 4/20 0.54
▸ POLB P06746 3/20 0.54
▸ ATM Q13315 1/20 0.54
▸ ADRA2C P18825 1/20 0.52
▸ GAA P10253 1/20 0.51
▸ MTNR1B P49286 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.49
▸ KMT2A Q03164 4/20 0.47
▸ LMNA P02545 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ MITF O75030 1/20 0.47
▸ HPGD P15428 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46

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
SCHEMBL30668811 1.00 PPARG (0.55) PPARGL3MBTL1POLBATMADRA2C
SCHEMBL18666146 0.89 ADRA2C (0.54) PPARGL3MBTL1POLBATMADRA2C
SCHEMBL29660113 0.89 ADRA2C (0.54) PPARGL3MBTL1POLBATMADRA2C
SCHEMBL18666199 0.81 DEGS1 (0.49) PPARGL3MBTL1POLBADRA2CGAA
SCHEMBL18666149 0.81 ALDH1A1 (0.55) POLBMTNR1BTDP1KMT2ALMNA
SCHEMBL18666157 0.81 ALDH1A1 (0.48) PPARGL3MBTL1POLBADRA2CGAA
SCHEMBL18666150 0.80 MTNR1B (0.47) PPARGL3MBTL1ADRA2CGAAMTNR1B
SCHEMBL18666151 0.79 MTNR1B (0.63) POLBMTNR1BTDP1KMT2ALMNA
SCHEMBL21675770 0.79 ALDH1A1 (0.45) PPARGL3MBTL1POLBADRA2CGAA
SCHEMBL30567101 0.79 MTNR1B (0.63) POLBMTNR1BTDP1KMT2ALMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4490142-A2 PCNA INHIBITORS AND USES THEREOF City of Hope (US) 2025-01-15 — — EP disclosed
WO-2023172880-A2 PCNA INHIBITORS AND USES THEREOF CITY OF HOPE (US) 2023-09-14 — — WO disclosed
WO-2023172880-A2 PCNA INHIBITORS AND USES THEREOF CITY OF HOPE (US) 2023-09-14 — — WO disclosed
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