SCHEMBL31184793

SCHEMBL31184793

COc1ccc(NC(=O)C2(C)CCC(N3Cc4c(C)ccc(OC)c4NC3=O)CC2)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ MAPT P10636 5/20 0.42
▸ RECQL P46063 1/20 0.42
▸ HPGD P15428 1/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ MALT1 Q9UDY8 5/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 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
SCHEMBL31184672 0.92 MAPT (0.36) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL31184478 0.92 MAPT (0.38) ALDH1A1MAPTRECQLKMT2AMEN1
SCHEMBL31184867 0.88 ALDH1A1 (0.44) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL31184579 0.88 ALDH1A1 (0.42) ALDH1A1MAPTRECQLHPGDKMT2A
SCHEMBL31184603 0.86 MALT1 (0.52) ALDH1A1MAPTHPGDMALT1SMN1; SMN2
SCHEMBL31184987 0.83 HTR2B (0.36) MAPTTP53
SCHEMBL31184984 0.80 HTR2A (0.38) MAPTKMT2AMEN1LMNATP53
SCHEMBL31184643 0.80 PARP1 (0.37) MAPTKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL31185021 0.80 MAPT (0.36) ALDH1A1MAPTRECQLKMT2AMEN1
SCHEMBL31184638 0.80 PARP1 (0.37) MAPTKMT2AMEN1SMN1; SMN2LMNA

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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