SCHEMBL9671809

SCHEMBL9671809

O=C1NC(=O)C2(N1)c1ccccc1-c1ncccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITGA4 P13612 1/20 0.68
▸ AKR1B1 P15121 6/20 0.54
▸ AKR1A1 P14550 5/20 0.54
▸ CRHBP P24387 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ BLM P54132 2/20 0.45
▸ CACNA1F O60840 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ HTR2A P28223 1/20 0.45
▸ HRH1 P35367 1/20 0.45
▸ SCN1A P35498 1/20 0.45
▸ SCN4A P35499 1/20 0.45
▸ PMP22 Q01453 1/20 0.45
▸ CACNA1D Q01668 1/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ CACNA1S Q13698 1/20 0.45
▸ CACNA1C Q13936 1/20 0.45
▸ SCN5A Q14524 1/20 0.45

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
SCHEMBL9671558 0.84 AKR1B1 (0.59) ITGA4AKR1B1AKR1A1CRHBPCRHR2
SCHEMBL9672105 0.84 AKR1A1 (0.68) ITGA4AKR1B1AKR1A1
SCHEMBL10907091 0.84 AKR1B1 (0.68) ITGA4AKR1B1AKR1A1CRHBPCRHR2
SCHEMBL22380689 0.82 ITGA4 (0.68) ITGA4AKR1B1AKR1A1CRHBPCRHR2
SCHEMBL9810959 0.82 ITGA4 (1.00) ITGA4AKR1B1AKR1A1CRHBPCRHR2
SCHEMBL31195728 0.82 ITGA4 (1.00) ITGA4AKR1B1AKR1A1CRHBPCRHR2
SCHEMBL9671858 0.80 TDP1 (0.49) ITGA4AKR1B1AKR1A1MAPTTDP2
SCHEMBL25063677 0.79 AKR1A1 (0.43) ITGA4AKR1B1AKR1A1CRHBPCRHR2
SCHEMBL22380713 0.77 AKR1B1 (0.44) ITGA4AKR1B1AKR1A1CRHBPCRHR2
SCHEMBL25063575 0.76 ITGA4 (0.58) ITGA4AKR1B1AKR1A1CRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230190710-A1 COMPOSITIONS AND METHODS OF REDUCING SERUM CHOLESTEROL AND PCSK9 UNIV CASE WESTERN RESERVE (US) 2023-06-22 — — US disclosed
US-11576900-B2 Compositions and methods of reducing serum cholesterol and PCSK9 CASE WESTERN RESERVE UNIVERSITY (US) 2023-02-14 — — US disclosed
EP-0137333-B1 SPIRO-TRICYCLICAROMATIC SUCCINIMIDE DERIVATIVES AS INHIBITORS OF ALDOSE REDUCTASE ALCON LABORATORIES, INC. (US) 1992-12-30 — — EP disclosed
US-5153211-A Enzyme inhibitors ALCON LABORATORIES, INC. (US) 1992-10-06 — — US disclosed
US-5070100-A COMPLICATIONS OF DIABETES ALCON LABORATORIES, INC. (US) 1991-12-03 — — US disclosed
US-4864028-A ANTIDIABETIC AGENTS ALCON LABORATORIES, INC. (US) 1989-09-05 — — US disclosed
US-4717725-A SPIROCYCLIC AROMATIC IMIDES ALCON LABORATORIES, INC. (US) 1988-01-05 — — US disclosed
US-4540700-A Treatment of diabetic complications with certain spiro-imidazolidine-diones ALCON LABORATORIES, INC. (US) 1985-09-10 — — US disclosed
US-4537892-A ANTIDIABETIC AGENTS ALCON LABORATORIES, INC. (US) 1985-08-27 — — US disclosed
EP-0137333-A2 Spiro-tricyclicaromatic succinimide derivatives as inhibitors of aldose reductase ALCON LABORATORIES, INC. (US) 1985-04-17 — — EP disclosed
US-4436745-A TETRACYCLIC SPIROHYDANTOINS ALCON LABORATORIES, INC. (US) 1984-03-13 — — 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 (2 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-11576900-B2 Compositions and methods of reducing serum cholesterol and PCSK9 PCSK9, HMGCR, PCSK7 ITGA4 4832/4885AKR1B1 9/4885AKR1A1 8/4885
US-20230190710-A1 COMPOSITIONS AND METHODS OF REDUCING SERUM CHOLESTEROL AND PCSK9 PCSK9, HMGCR, PCSK7 ITGA4 4832/4885AKR1B1 9/4885AKR1A1 8/4885

“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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