SCHEMBL30567110

SCHEMBL30567110

O=C(CNC(=O)c1cccc2ccccc12)Nc1ccccc1Sc1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.53
▸ ALDH1A1 P00352 6/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ GLA P06280 1/20 0.50
▸ KMT2A Q03164 6/20 0.46
▸ LMNA P02545 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ BLM P54132 2/20 0.45
▸ NOD2 Q9HC29 1/20 0.45
▸ AGER Q15109 1/20 0.44
▸ HDAC2 Q92769 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ TAOK1 Q7L7X3 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43

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
SCHEMBL25387819 1.00 MAPK1 (0.53) MAPK1ALDH1A1L3MBTL1GLAKMT2A
SCHEMBL25386145 0.91 ALDH1A1 (0.54) MAPK1ALDH1A1L3MBTL1GLAKMT2A
SCHEMBL31256612 0.91 ALDH1A1 (0.54) MAPK1ALDH1A1L3MBTL1GLAKMT2A
SCHEMBL30567121 0.90 MAPK1 (0.46) MAPK1ALDH1A1L3MBTL1GLAKMT2A
SCHEMBL25386759 0.90 MAPK1 (0.46) MAPK1ALDH1A1L3MBTL1GLAKMT2A
SCHEMBL25386852 0.89 L3MBTL1 (0.50) ALDH1A1L3MBTL1KMT2ALMNAMEN1
SCHEMBL30567126 0.89 RXFP1 (0.47) MAPK1ALDH1A1L3MBTL1KMT2ALMNA
SCHEMBL25386208 0.89 RXFP1 (0.47) MAPK1ALDH1A1L3MBTL1KMT2ALMNA
SCHEMBL25388161 0.87 KMT2A (0.53) ALDH1A1KMT2AMEN1AGERHDAC2
SCHEMBL30567095 0.87 KMT2A (0.53) ALDH1A1KMT2AMEN1AGERHDAC2

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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