SCHEMBL4259962

SCHEMBL4259962

COc1cccc(CN2C(=O)C3(NC(=O)NC3=O)c3cc(F)ccc32)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKR1A1 P14550 3/20 0.50
AKR1B1 P15121 3/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CMA1 P23946 1/20 0.47
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
PTGDR2 Q9Y5Y4 3/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
CHRM5 P08912 1/20 0.42
PKM P14618 1/20 0.41
SCN9A Q15858 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
SCHEMBL4260196 0.89 MEN1 (0.51) MEN1KMT2ACMA1MAPTPTGDR2
SCHEMBL4260419 0.85 PARK7 (0.51) AKR1A1AKR1B1PTGDR2
SCHEMBL4253055 0.80 CHRM5 (0.46) MEN1KMT2ACHRM5
SCHEMBL4174602 0.80 ALDH1A1 (0.43) AKR1A1AKR1B1GAAPTGDR2TP53
SCHEMBL10955668 0.79 AKR1B1 (0.47) AKR1A1AKR1B1KMT2AMAPTPTGDR2
SCHEMBL4164986 0.79 PARK7 (0.64) AKR1A1AKR1B1MAPTPTGDR2TP53
SCHEMBL11048622 0.79 SCN9A (0.41) AKR1A1AKR1B1CMA1PTGDR2CHRM5
SCHEMBL4254391 0.78 MEN1 (0.46) AKR1A1AKR1B1MEN1KMT2ACMA1
SCHEMBL4255745 0.78 AKR1B1 (0.47) AKR1A1AKR1B1PTGDR2TP53
SCHEMBL4164837 0.78 AKR1B1 (0.48) AKR1A1AKR1B1MAPTPTGDR2POLB

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 AKR1A1 317/4885AKR1B1 366/4885MEN1 1859/4885

“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.