SCHEMBL31184541

SCHEMBL31184541

Cc1cc(NCCN(C)C)cc2c1CN(C1CCC(C(=O)O)CC1)C(=O)N2

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.38
▸ CALCA P06881 1/20 0.32
▸ CALCRL Q16602 1/20 0.30
▸ CHRM4 P08173 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
SCHEMBL31184615 0.84 LMNA (0.31) —
SCHEMBL31184418 0.83 ALDH1A1 (0.39) —
SCHEMBL31184593 0.83 ALDH1A1 (0.39) —
SCHEMBL31185032 0.81 MALT1 (0.44) —
SCHEMBL31184917 0.80 ALDH1A1 (0.38) —
SCHEMBL31184692 0.77 JAK2 (0.39) JAK2
SCHEMBL31184568 0.76 MAPK1 (0.32) —
SCHEMBL31184750 0.75 BTK (0.34) —
SCHEMBL31184907 0.72 JAK2 (0.40) JAK2CALCRLCHRM4
SCHEMBL31184661 0.68 ALDH1A1 (0.34) JAK2

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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