SCHEMBL4257629

SCHEMBL4257629

Cc1cc(Cl)cc2c1N(C/C=C/c1ccccc1)C(=O)C21NC(=O)NC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.40
ALDH1A1 P00352 6/20 0.40
ALDH2 P05091 1/20 0.40
AKR1B1 P15121 3/20 0.38
AKR1A1 P14550 2/20 0.38
RCE1 Q9Y256 2/20 0.34
ALDH3A1 P30838 1/20 0.34
MAPT P10636 3/20 0.33
USP2 O75604 2/20 0.33
CACNA1F O60840 1/20 0.33
CYP2C9 P11712 1/20 0.33
HTR2A P28223 1/20 0.33
HRH1 P35367 1/20 0.33
SCN1A P35498 1/20 0.33
SCN4A P35499 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
CACNA1D Q01668 1/20 0.33
KCNH2 Q12809 1/20 0.33
CACNA1S Q13698 1/20 0.33

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
SCHEMBL4256975 0.85 AKR1B1 (0.39) AKR1B1AKR1A1MMP2MMP3MMP8
SCHEMBL4260042 0.83 CNR1 (0.43) PTGDR2ALDH1A1AKR1B1AKR1A1MAPT
SCHEMBL4253008 0.82 AKR1B1 (0.39) PTGDR2AKR1B1AKR1A1MMP2MMP3
SCHEMBL4161031 0.81 CNR1 (0.46) PTGDR2ALDH1A1ALDH2AKR1B1AKR1A1
SCHEMBL4255513 0.78 PTGDR2 (0.40) PTGDR2ALDH1A1ALDH2AKR1B1RCE1
SCHEMBL4254387 0.76 CNR1 (0.42) AKR1B1AKR1A1MMP2MMP3MMP8
SCHEMBL4261580 0.76 AKR1B1 (0.44) PTGDR2ALDH1A1ALDH2AKR1B1AKR1A1
SCHEMBL4163352 0.76 AKR1B1 (0.38) ALDH1A1AKR1B1AKR1A1MMP2MMP3
SCHEMBL23390595 0.75 AKR1A1 (0.39) ALDH1A1AKR1B1AKR1A1MAPTHSD17B10
SCHEMBL4178111 0.75 AKR1B1 (0.39) PTGDR2ALDH1A1AKR1B1AKR1A1MMP2

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 PTGDR2 193/4885ALDH1A1 502/4885ALDH2 1126/4885

“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.