SCHEMBL31184468

SCHEMBL31184468

COc1ccc(NC(=O)C2CCC(N3Cc4c(C)cccc4C3=O)CC2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.44
▸ TSHR P16473 2/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ POLB P06746 3/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ MALT1 Q9UDY8 2/20 0.42
▸ TYK2 P29597 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ BACE1 P56817 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ TDO2 P48775 1/20 0.41
▸ MET P08581 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ LMNA P02545 1/20 0.40

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
SCHEMBL31184640 0.92 POLB (0.45) TSHRKMT2AHPGDPOLBMAPK1
SCHEMBL31184475 0.92 POLB (0.49) TP53KMT2AHPGDPOLBMAPK1
SCHEMBL31184972 0.90 POLB (0.44) TSHRKMT2AHPGDPOLBMAPK1
SCHEMBL31184902 0.89 MALT1 (0.54) TSHRHPGDMALT1ALDH1A1SMN1; SMN2
SCHEMBL31184780 0.89 MAPK1 (0.43) TP53TSHRKMT2APOLBMAPK1
SCHEMBL31184595 0.89 KDR (0.46) TSHRKMT2AHPGDPOLBMAPK1
SCHEMBL31184818 0.89 ALDH1A1 (0.46) TSHRKMT2AHPGDPOLBMAPK1
SCHEMBL31184761 0.88 MAPT (0.43) TSHRKMT2AHPGDPOLBMAPK1
SCHEMBL31184499 0.88 MALT1 (0.46) KMT2APOLBMAPK1MALT1TYK2
SCHEMBL31184820 0.88 MAPK1 (0.49) TP53TSHRKMT2AHPGDPOLB

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-2024220626-A1 SMALL MOLECULE MODULATORS OF OGG1 AZKARRA THERAPEUTICS, INC. (US) 2024-10-24 — — WO disclosed
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