SCHEMBL25309723

SCHEMBL25309723

COc1cccc(F)c1OC(=O)c1ccc(C)nc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ SLC2A1 P11166 1/20 0.47
▸ SLC2A4 P14672 1/20 0.47
▸ POLB P06746 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ KCNQ3 O43525 1/20 0.40
▸ KCNQ2 O43526 1/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTR5A P47898 1/20 0.38

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
SCHEMBL25307646 0.90 KMT2A (0.48) KMT2AMEN1SLC2A1SLC2A4POLB
SCHEMBL25308360 0.87 KMT2A (0.46) KMT2AMEN1POLBATMTHRB
SCHEMBL25309554 0.85 KMT2A (0.46) KMT2AMEN1POLBATMTHRB
SCHEMBL25308546 0.83 KMT2A (0.57) KMT2AMEN1SLC2A1SLC2A4ATM
SCHEMBL25311726 0.81 KMT2A (0.41) KMT2AMEN1POLBATMTHRB
SCHEMBL25308514 0.79 KMT2A (0.57) KMT2AMEN1POLBATMTHRB
SCHEMBL6726742 0.78 KMT2A (0.50) KMT2AMEN1ATMMAPTKDM4E
SCHEMBL25307755 0.74 KMT2A (0.41) KMT2AMEN1POLBATMTHRB
SCHEMBL21708685 0.73 KMT2A (0.56) KMT2AMEN1SLC2A1SLC2A4POLB
SCHEMBL30574349 0.70 MAPK1 (0.67) KMT2AMEN1ATMMAPTALDH1A1

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
WO-2024099337-A1 THIADIAZOLYL DERIVATIVES, COMPOSITIONS, AND USES THEREOF DANATLAS PHARMACEUTICALS CO., LTD. (CN) 2024-05-16 — — WO disclosed
WO-2024099336-A1 THIADIAZOLYL DERIVATIVES, COMPOSITIONS AND USES THEREOF DANATLAS PHARMACEUTICALS CO., LTD. (CN) 2024-05-16 — — WO disclosed
WO-2023134708-A1 THIAZOLOPYRIDYL AMIDE DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS BEIGENE , LTD. (KY) 2023-07-20 — — WO disclosed
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