SCHEMBL22461455

SCHEMBL22461455

C=CC(=O)N1Cc2ccc(Oc3cccnc3)cc2[C@H](c2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 13/20 0.44
▸ EGFR P00533 2/20 0.42
▸ LCK P06239 2/20 0.42
▸ SLC6A2 P23975 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ BLK P51451 4/20 0.41
▸ LYN P07948 2/20 0.40
▸ KRAS P01116 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL22461190 1.00 BTK (0.44) BTKEGFRLCKSLC6A2SLC6A4
SCHEMBL24489979 0.92 BTK (0.39) BTKEGFRLCKSLC6A2SLC6A4
SCHEMBL22461450 0.90 SLC6A2 (0.47) BTKEGFRSLC6A2SLC6A4SLC6A3
SCHEMBL22461454 0.90 SLC6A2 (0.47) BTKEGFRSLC6A2SLC6A4SLC6A3
SCHEMBL22461209 0.83 BTK (0.40) BTKEGFRLCKBLKLYN
SCHEMBL24489983 0.83 MAPT (0.43) BTKSLC6A2SLC6A4SLC6A3
SCHEMBL22460910 0.82 SLC6A2 (0.41) BTKSLC6A2SLC6A4SLC6A3
SCHEMBL24489998 0.82 SLC6A2 (0.62) BTKEGFRSLC6A2SLC6A4SLC6A3
SCHEMBL22461555 0.82 SLC6A2 (0.62) BTKEGFRSLC6A2SLC6A4SLC6A3
SCHEMBL24489980 0.79 SLC6A2 (0.39) BTKEGFRSLC6A2SLC6A4SLC6A3

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 BTK 3846/4885EGFR 3285/4885LCK 3778/4885

“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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