SCHEMBL24490216

SCHEMBL24490216

C=CC(=O)N1Cc2cc(/C=C/C(=O)N3Cc4ccccc4[C@@H](c4cccc(OC)c4)C3)ccc2[C@H](c2cccc(OC)c2)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ ACHE P22303 6/20 0.43
▸ CCR2 P41597 1/20 0.42
▸ GID4 Q8IVV7 1/20 0.42
▸ SLC6A2 P23975 2/20 0.41
▸ SLC6A4 P31645 2/20 0.41
▸ SLC6A3 Q01959 2/20 0.41
▸ BCHE P06276 4/20 0.41
▸ MAOA P21397 4/20 0.41
▸ MAOB P27338 4/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GPR183 P32249 1/20 0.40

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
SCHEMBL22460949 0.91 KIF11 (0.37) KIF11ALDH1A1MAPTACHECCR2
SCHEMBL22460902 0.91 KIF11 (0.53) KIF11GID4SLC6A2SLC6A4SLC6A3
SCHEMBL22460919 0.91 KIF11 (0.53) KIF11GID4SLC6A2SLC6A4SLC6A3
SCHEMBL24490161 0.89 ESR1 (0.44) ALDH1A1MAPTACHESLC6A2SLC6A4
SCHEMBL24490371 0.87 KIF11 (0.48) KIF11MAPT
SCHEMBL24490097 0.82 SLC6A4 (0.62) KIF11SLC6A2SLC6A4SLC6A3
SCHEMBL24490020 0.82 SLC6A4 (0.62) KIF11SLC6A2SLC6A4SLC6A3
SCHEMBL24490249 0.81 KIF11 (0.41) KIF11GID4SLC6A2SLC6A4SLC6A3
SCHEMBL24490248 0.81 KIF11 (0.41) KIF11GID4SLC6A2SLC6A4SLC6A3
SCHEMBL24490268 0.81 NPC1 (0.42) ALDH1A1MAPTACHECCR2BCHE

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
US-20220177488-A1 SUMO INHIBITOR COMPOUNDS AND USES THEREOF CIT THERAPEUTICS LLC 2022-06-09 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220177488-A1 SUMO INHIBITOR COMPOUNDS AND USES THEREOF SUMO1, SUMO2, SUMO3 KIF11 3058/4885ALDH1A1 1950/4885MAPT 2442/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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