SCHEMBL4157299

SCHEMBL4157299

COCCN1C(=O)NC2(C1=O)C(=O)N(C/C=C/c1ccc(Cl)c(Cl)c1)c1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 2/20 0.36
BACE1 P56817 2/20 0.35
PLAT P00750 1/20 0.35
PTGDR2 Q9Y5Y4 4/20 0.35
GAA P10253 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
RCE1 Q9Y256 1/20 0.34
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.33
HPGD P15428 2/20 0.32
POLB P06746 1/20 0.32
GLA P06280 1/20 0.32
ALDH2 P05091 1/20 0.31

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
SCHEMBL4168480 0.88 ALDH1A1 (0.36) ALDH1A1KDM4EPLATPTGDR2GAA
SCHEMBL4165985 0.83 ALDH1A1 (0.36) ALDH1A1KDM4EPLATPTGDR2GAA
SCHEMBL950207 0.81 AKR1B1 (0.37) ALDH1A1KDM4EPTGDR2GAAHSD17B10
SCHEMBL949680 0.81 AKR1B1 (0.37) ALDH1A1KDM4EPTGDR2GAAHSD17B10
SCHEMBL953677 0.81 AKR1B1 (0.37) ALDH1A1KDM4EPTGDR2GAAHSD17B10
SCHEMBL4170292 0.74 ALDH1A1 (0.36) ALDH1A1PTGDR2GAAHSD17B10MAPT
SCHEMBL950142 0.70 AR (0.34) ALDH1A1KDM4EPTGDR2GAAHSD17B10
SCHEMBL949825 0.70 AR (0.34) ALDH1A1KDM4EPTGDR2GAAHSD17B10
SCHEMBL950827 0.70 AR (0.34) ALDH1A1KDM4EPTGDR2GAAHSD17B10
SCHEMBL4163278 0.68 AKR1B1 (0.44) ALDH1A1KDM4EBACE1GAAHSD17B10

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 7 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 disclosed
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
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
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
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
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
WO-2007091946-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) 2007-08-16 WO 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 (2 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 ALDH1A1 502/4885KDM4E 4537/4885BACE1 3680/4885
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 ALDH1A1 550/4885KDM4E 4232/4885BACE1 3577/4885

“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.