SCHEMBL31184741

SCHEMBL31184741

CCc1ccc(NC(=O)C2CCC(N3Cc4c(C)cccc4C3=O)CC2)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.43
▸ POLB P06746 1/20 0.42
▸ TYK2 P29597 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ MALT1 Q9UDY8 4/20 0.41
▸ TP53 P04637 1/20 0.41
▸ ACHE P22303 1/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CHKA P35790 1/20 0.39
▸ CHKB Q9Y259 1/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL31184851 0.94 POLB (0.41) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184660 0.92 SMN1; SMN2 (0.42) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184972 0.91 POLB (0.44) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184640 0.91 POLB (0.45) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184475 0.91 POLB (0.49) MAPTPOLBALDH1A1MAPK1MALT1
SCHEMBL31184817 0.90 MAPT (0.43) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184761 0.89 MAPT (0.43) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184499 0.89 MALT1 (0.46) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184419 0.89 POLB (0.42) MAPTPOLBTYK2ALDH1A1SMN1; SMN2
SCHEMBL31184468 0.87 TP53 (0.44) MAPTPOLBTYK2ALDH1A1SMN1; SMN2

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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