SCHEMBL4169609

SCHEMBL4169609

O=C1NC(=O)C2(N1)C(=O)N(CCn1cccc1)c1ccc(F)cc12

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 16/20 0.48
AKR1A1 P14550 12/20 0.48
PARK7 Q99497 1/20 0.42

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
SCHEMBL4169748 0.86 AKR1B1 (0.48) AKR1B1AKR1A1
SCHEMBL4167713 0.86 AKR1B1 (0.40) AKR1B1
SCHEMBL4169851 0.84 ITGA4 (0.44) AKR1B1AKR1A1
SCHEMBL4164986 0.83 PARK7 (0.64) AKR1B1AKR1A1PARK7
SCHEMBL4164837 0.81 AKR1B1 (0.48) AKR1B1AKR1A1PARK7
SCHEMBL4259941 0.81 AKR1B1 (0.48) AKR1B1AKR1A1PARK7
SCHEMBL4260210 0.81 AKR1B1 (0.48) AKR1B1AKR1A1PARK7
SCHEMBL4176442 0.80 AKR1A1 (0.46) AKR1B1AKR1A1PARK7
SCHEMBL4260419 0.80 PARK7 (0.51) AKR1B1AKR1A1PARK7
SCHEMBL4171777 0.80 AKR1B1 (0.46) AKR1B1AKR1A1PARK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-03-19 US claimed
US-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-03-19 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 (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-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 TRPV1, TRPV5, TRPV2 AKR1B1 344/4885AKR1A1 310/4885PARK7 1295/4885

“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.