SCHEMBL31184403

SCHEMBL31184403

Cc1cc(NCCN(C)C)cc2c1CN(C1CCC(C(=O)Nc3ccn(CCO)n3)CC1)C2=O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 3/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ ABL1 P00519 2/20 0.32
▸ NPY5R Q15761 4/20 0.32
▸ PIP5K1C O60331 2/20 0.31
▸ PIK3CA P42336 2/20 0.31
▸ MAP3K5 Q99683 1/20 0.31
▸ MCHR1 Q99705 1/20 0.30
▸ KDM4E B2RXH2 2/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL31185051 0.88 DGAT1 (0.31) —
SCHEMBL31184615 0.80 LMNA (0.31) —
SCHEMBL31184614 0.80 ALDH1A1 (0.40) TYK2ALDH1A1HPGD
SCHEMBL31184524 0.80 CHKA (0.34) MAP3K5ALDH1A1
SCHEMBL31184568 0.79 MAPK1 (0.32) ALDH1A1
SCHEMBL31184992 0.79 MGLL (0.41) MCHR1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL31184642 0.79 ALDH1A1 (0.40) TYK2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL31184750 0.79 BTK (0.34) ALDH1A1
SCHEMBL31184822 0.78 CYP1A2 (0.42) ABL1ALDH1A1
SCHEMBL31185053 0.78 TP53 (0.40) ALDH1A1HPGD

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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