SCHEMBL9672018

SCHEMBL9672018

O=C1CC2(C(=O)N1)c1cc(F)ccc1-c1ccc(F)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 9/20 0.69
▸ AKR1A1 P14550 5/20 0.52
▸ AKR1B10 O60218 1/20 0.52
▸ CYP1A2 P05177 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44

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
SCHEMBL9671705 0.92 AKR1B1 (0.61) AKR1B1AKR1A1AKR1B10
SCHEMBL10929003 0.91 AKR1B1 (0.60) AKR1B1AKR1A1AKR1B10CYP1A2MAPT
SCHEMBL21844215 0.87 AKR1B1 (0.62) AKR1B1AKR1A1AKR1B10
SCHEMBL9672965 0.87 AKR1B1 (0.56) AKR1B1AKR1A1AKR1B10CYP1A2MAPT
SCHEMBL9673456 0.85 AKR1B1 (0.57) AKR1B1AKR1A1AKR1B10CYP1A2MAPT
SCHEMBL10345515 0.83 AKR1B1 (0.55) AKR1B1AKR1A1AKR1B10
SCHEMBL10930198 0.83 AKR1B1 (0.55) AKR1B1AKR1A1AKR1B10
SCHEMBL10975155 0.82 AKR1B1 (0.51) AKR1B1AKR1A1AKR1B10MAPT
SCHEMBL10929989 0.81 AKR1B1 (0.56) AKR1B1AKR1A1AKR1B10CYP1A2MAPT
SCHEMBL9673557 0.74 AKR1B1 (0.45) AKR1B1

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 13 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
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-0306525-A4 USE OF ALDOSE REDUCTASE INHIBITORS TO ENHANCE INSULIN SENSITIVITY IN DIABETES MELLITUS — 1991-04-24 — — EP 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
EP-0306525-A1 USE OF ALDOSE REDUCTASE INHIBITORS TO ENHANCE INSULIN SENSITIVITY IN DIABETES MELLITUS ALCON LABORATORIES, INC. (US) 1989-03-15 — — EP disclosed
WO-1988006887-A1 USE OF ALDOSE REDUCTASE INHIBITORS TO ENHANCE INSULIN SENSITIVITY IN DIABETES MELLITUS ALCON LABORATORIES, INC. (US) 1988-09-22 — — WO 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
EP-0137333-A2 Spiro-tricyclicaromatic succinimide derivatives as inhibitors of aldose reductase ALCON LABORATORIES, INC. (US) 1985-04-17 — — EP disclosed
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