SCHEMBL9672105

SCHEMBL9672105

O=C1NC(=O)C2(N1)c1cc(F)ccc1-c1ncccc12

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AKR1A1 P14550 18/20 0.68
▸ AKR1B1 P15121 18/20 0.68
▸ ITGA4 P13612 1/20 0.47

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 0.85 AKR1B1 (0.59) AKR1A1AKR1B1ITGA4
SCHEMBL10907091 0.85 AKR1B1 (0.68) AKR1A1AKR1B1ITGA4
SCHEMBL9671809 0.84 ITGA4 (0.68) AKR1A1AKR1B1ITGA4
SCHEMBL9674157 0.82 AKR1A1 (0.68) AKR1A1AKR1B1ITGA4
Imirestat SCHEMBL30924520 0.82 AKR1A1 (1.00) AKR1A1AKR1B1ITGA4
Imirestat SCHEMBL49034 0.82 AKR1A1 (1.00) AKR1A1AKR1B1ITGA4
Alconil SCHEMBL1201487 0.81 AKR1A1 (0.85) AKR1A1AKR1B1ITGA4
Alconil SCHEMBL30661866 0.81 AKR1A1 (0.85) AKR1A1AKR1B1ITGA4
SCHEMBL9671858 0.81 TDP1 (0.49) AKR1A1AKR1B1ITGA4
SCHEMBL10929554 0.80 AKR1A1 (0.64) AKR1A1AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4609663-A Aldose reductase inhibitors useful in glaucoma therapy ALCON LABORATORIES, INC. (US) 1986-09-02 — — US claimed
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
EP-0258476-B1 ALDOSE REDUCTASE INHIBITORS USEFUL IN GLAUCOMA THERAPY ALCON LABORATORIES, INC. (US) 1990-04-25 — — EP 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-4609663-A Aldose reductase inhibitors useful in glaucoma therapy ALCON LABORATORIES, INC. (US) 1986-09-02 — — US disclosed
US-4600717-A Aldose reductase inhibitors useful in ophthalmic wound healing ALCON LABORATORIES, INC. (US) 1986-07-15 — — US disclosed
US-4537892-A ANTIDIABETIC AGENTS ALCON LABORATORIES, INC. (US) 1985-08-27 — — US disclosed
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