SCHEMBL31184422

SCHEMBL31184422

Cc1cccc2c1CN(C1CCC(C(=O)Nc3cccc(=O)[nH]3)CC1)C2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ KMT2A Q03164 3/20 0.38
▸ TSHR P16473 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ IDH1 O75874 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ CDK4 P11802 1/20 0.36
▸ NUDT1 P36639 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ GSPT1 P15170 1/20 0.35
▸ CRBN Q96SW2 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ GRM1 Q13255 1/20 0.34
▸ TYK2 P29597 1/20 0.34

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
SCHEMBL31184828 0.84 CDK4 (0.41) MAPK1HTR2AHTR2CHTR2BKMT2A
SCHEMBL31184428 0.82 KMT2A (0.43) MAPK1HTR2AHTR2CHTR2BKMT2A
SCHEMBL31185026 0.81 KMT2A (0.48) MAPK1KMT2ATSHRKDM4EALDH1A1
SCHEMBL31184409 0.81 ALDH1A1 (0.40) MAPK1HTR2AHTR2CHTR2BKMT2A
SCHEMBL31184979 0.80 ALDH1A1 (0.46) MAPK1KMT2ATSHRKDM4EALDH1A1
SCHEMBL31184816 0.80 MAPK1 (0.48) MAPK1HTR2AHTR2CHTR2BKMT2A
SCHEMBL31184763 0.80 EPHX2 (0.49) KMT2ATSHRALDH1A1MEN1HPGD
SCHEMBL31184994 0.80 GRM1 (0.44) KMT2ATSHRALDH1A1MEN1HPGD
SCHEMBL31184529 0.79 MAPK1 (0.49) MAPK1HTR2AHTR2CHTR2BKMT2A
SCHEMBL31184452 0.78 MAPK1 (0.51) MAPK1HTR2AHTR2CHTR2BKMT2A

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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