SCHEMBL29750672

SCHEMBL29750672

Cc1nc2c([N+](=O)[O-])cccc2cc1C(CC(N)=O)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.35
▸ MEN1 O00255 7/20 0.35
▸ KMT2A Q03164 7/20 0.35
▸ LMNA P02545 6/20 0.35
▸ GAA P10253 1/20 0.35
▸ ALDH1A1 P00352 9/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ GSTP1 P09211 1/20 0.33
▸ GSTM2 P28161 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP26A1 O43174 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL29750770 0.90 MEN1 (0.34) MAPTMEN1KMT2ALMNAGAA
SCHEMBL24745629 0.90 MEN1 (0.34) MAPTMEN1KMT2ALMNAGAA
SCHEMBL29098597 0.85 MAPT (0.36) MAPTMEN1KMT2ALMNAGAA
SCHEMBL29750575 0.85 MAPT (0.36) MAPTMEN1KMT2ALMNAGAA
SCHEMBL29750507 0.84 MAPT (0.35) MAPTMEN1KMT2ALMNAGAA
SCHEMBL24744948 0.84 MAPT (0.35) MAPTMEN1KMT2ALMNAGAA
SCHEMBL29098598 0.76 ALDH1A1 (0.38) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL29750564 0.76 ALDH1A1 (0.38) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL29098594 0.76 PRNP (0.34) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL29750508 0.76 PRNP (0.34) MAPTMEN1KMT2ALMNAALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4271670-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF Captor Therapeutics S.A. (PL) 2023-11-08 — — EP disclosed
CN-116917275-A Novel CEREBLON-binding compounds and methods of use thereof 凯普托尔治疗学股份有限公司 2023-10-20 — — CN disclosed
WO-2022144416-A1 NOVEL COMPOUNDS WHICH BIND TO CEREBLON, AND METHODS OF USE THEREOF CAPTOR THERAPEUTICS S.A. (PL) 2022-07-07 — — WO disclosed
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