SCHEMBL24490097

SCHEMBL24490097

C=CC(=O)N1Cc2cc(OC)ccc2[C@@H](c2ccccc2)C1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 12/20 0.62
▸ SLC6A2 P23975 8/20 0.62
▸ SLC6A3 Q01959 8/20 0.62
▸ KIF11 P52732 3/20 0.59
▸ RYR2 Q92736 1/20 0.51
▸ ESR1 P03372 1/20 0.47
▸ ESR2 Q92731 1/20 0.47
▸ HRH3 Q9Y5N1 4/20 0.46

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
SCHEMBL24490020 1.00 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL24489998 0.91 SLC6A2 (0.62) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL22461555 0.91 SLC6A2 (0.62) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL24490106 0.89 KIF11 (0.52) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL24490102 0.89 KIF11 (0.52) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL22460921 0.88 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL22460901 0.88 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL22460902 0.88 KIF11 (0.53) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL22460919 0.88 KIF11 (0.53) SLC6A4SLC6A2SLC6A3KIF11RYR2
SCHEMBL24490016 0.86 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3KIF11ESR1

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 SLC6A4 4468/4885SLC6A2 4575/4885SLC6A3 4462/4885

“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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