SCHEMBL22461271

SCHEMBL22461271

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

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 5/20 0.55
▸ ESR1 P03372 4/20 0.52
▸ ESR2 Q92731 4/20 0.52
▸ SLC6A2 P23975 3/20 0.41
▸ SLC6A4 P31645 3/20 0.41
▸ SLC6A3 Q01959 3/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ DRD1 P21728 1/20 0.41
▸ ACHE P22303 1/20 0.40
▸ AVPR1A P37288 2/20 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
SCHEMBL22461269 1.00 KIF11 (0.55) KIF11ESR1ESR2SLC6A2SLC6A4
SCHEMBL22461277 0.91 KIF11 (0.45) KIF11ESR1ESR2SLC6A2SLC6A4
SCHEMBL22461281 0.91 KIF11 (0.45) KIF11ESR1ESR2SLC6A2SLC6A4
SCHEMBL22460962 0.88 KIF11 (0.48) KIF11ESR1ESR2SLC6A2SLC6A4
SCHEMBL22460956 0.88 KIF11 (0.48) KIF11ESR1ESR2SLC6A2SLC6A4
SCHEMBL24490179 0.87 KIF11 (0.50) KIF11ESR1ESR2
SCHEMBL29358133 0.87 KIF11 (0.50) KIF11ESR1ESR2
SCHEMBL24490183 0.87 KIF11 (0.50) KIF11ESR1ESR2
SCHEMBL22460925 0.87 DRD1 (0.50) KIF11ESR1ESR2DRD2DRD1
SCHEMBL22460978 0.87 DRD1 (0.50) KIF11ESR1ESR2DRD2DRD1

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
WO-2024086194-A1 COMBINATION THERAPY FOR TREATMENT OF CANCER Suvalent Therapeutics, Inc. (US) 2024-04-25 — — WO disclosed
US-20220177488-A1 SUMO INHIBITOR COMPOUNDS AND USES THEREOF CIT THERAPEUTICS LLC 2022-06-09 — — US disclosed
WO-2020191151-A1 SUMO INHIBITOR COMPOUNDS AND USES THEREOF ONCOVALENT THERAPEUTICS INC. (US) 2020-09-24 — — WO 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 3058/4885ESR1 741/4885ESR2 970/4885

“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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