SCHEMBL4252944

SCHEMBL4252944

Cc1ccc2c(c1)C1(NC(=O)NC1=O)C(=O)N2Cc1ccc(Br)cc1F

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 6/20 0.42
AKR1A1 P14550 2/20 0.41
AKR1B10 O60218 1/20 0.41

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
SCHEMBL10957429 0.90 AKR1B1 (0.53) AKR1B1AKR1A1AKR1B10
SCHEMBL11048812 0.88 PTGDR2 (0.50) AKR1B1AKR1A1AKR1B10
SCHEMBL10956203 0.86 AKR1B1 (0.51) AKR1B1AKR1A1AKR1B10
SCHEMBL4266563 0.86 HSP90AA1 (0.37) AKR1B1
SCHEMBL11007731 0.86 AKR1B1 (0.41) AKR1B1AKR1A1AKR1B10
SCHEMBL11047602 0.84 AKR1B1 (0.40) AKR1B1AKR1A1AKR1B10
SCHEMBL4254919 0.82 TSHR (0.39) AKR1B1
SCHEMBL4262827 0.80 AKR1B1 (0.47) AKR1B1AKR1A1
SCHEMBL4254345 0.79 PTGDR2 (0.42) AKR1B1AKR1A1
SCHEMBL4260018 0.79 TP53 (0.48)

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-20090176851-A1 Use of Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-07-09 US claimed
US-20090176851-A1 Use of Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-07-09 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-20090176851-A1 Use of Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 TRPV1, TRPV2, TRPV3 AKR1B1 366/4885AKR1A1 317/4885AKR1B10 651/4885

“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.