SCHEMBL30567137

SCHEMBL30567137

COc1cccc(Sc2ccccc2NC(=O)CNC(=O)c2cccc3ccccc23)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ HPGD P15428 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ LMNA P02545 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ MTNR1A P48039 1/20 0.44
▸ MTNR1B P49286 1/20 0.44
▸ NPC1 O15118 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ MAPK10 P53779 1/20 0.42

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
SCHEMBL25388664 1.00 POLB (0.49) POLBALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL25386145 0.87 ALDH1A1 (0.54) POLBALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL31256612 0.87 ALDH1A1 (0.54) POLBALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL25386759 0.85 MAPK1 (0.46) ALDH1A1HPGDL3MBTL1MEN1KMT2A
SCHEMBL30567121 0.85 MAPK1 (0.46) ALDH1A1HPGDL3MBTL1MEN1KMT2A
SCHEMBL25386473 0.84 ALDH1A1 (0.57) POLBALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL25386852 0.83 L3MBTL1 (0.50) ALDH1A1HPGDL3MBTL1MEN1KMT2A
SCHEMBL30567207 0.83 RXFP1 (0.53) POLBALDH1A1HPGDL3MBTL1MEN1
SCHEMBL25385840 0.83 RXFP1 (0.53) POLBALDH1A1HPGDL3MBTL1MEN1
SCHEMBL18666151 0.81 MTNR1B (0.63) POLBALDH1A1KDM4EMEN1KMT2A

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
CN-119013247-A PCNA inhibitor and use thereof 希望之城 2024-11-22 — — CN disclosed
WO-2023172880-A2 PCNA INHIBITORS AND USES THEREOF CITY OF HOPE (US) 2023-09-14 — — WO disclosed
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