SCHEMBL6493230

SCHEMBL6493230

CN(C)c1ncccc1C=Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.50
RELA Q04206 1/20 0.47
KDM4E B2RXH2 2/20 0.45
NFE2L2 Q16236 3/20 0.43
TRPA1 O75762 2/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
APP P05067 1/20 0.42
SNCA P37840 1/20 0.42
GRM4 Q14833 1/20 0.40
ATP4A P20648 2/20 0.38
ATP4B P51164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
ALK Q9UM73 1/20 0.38

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
SCHEMBL9000291 0.81 KDM4E (0.38) KDM4EAPPSNCAALDH1A1
SCHEMBL4160827 0.77 NFE2L2 (0.47) KDM4ENFE2L2TRPA1CYP11B1CYP11B2
SCHEMBL29094920 0.77 KDM4E (0.49) GRM5KDM4ENFE2L2TRPA1CYP11B1
SCHEMBL4160819 0.77 NFE2L2 (0.47) KDM4ENFE2L2TRPA1CYP11B1CYP11B2
SCHEMBL9166069 0.76 KDM4E (0.51) KDM4ENFE2L2TRPA1CYP11B1CYP11B2
SCHEMBL29954331 0.74 TRIM24 (0.52) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL12253115 0.74 TRIM24 (0.52) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL18726709 0.74 KDM4E (0.37) KDM4EALDH1A1
SCHEMBL20153719 0.74 KDM4E (0.37) KDM4EAPPSNCAALDH1A1
SCHEMBL3397695 0.74 FGF23 (0.51) KDM4ENFE2L2TRPA1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050260126-A1 Diagnostic probes and remedies for diseases with accumulation of prion protein, and stains for prion protein BF RESEARCH INSTITUTE (JP) 2005-11-24 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-20050260126-A1 Diagnostic probes and remedies for diseases with accumulation of prion protein, and stains for prion protein PRNP, PRPH, PCNP GRM5 3408/4885RELA 3311/4885KDM4E 4402/4885

“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.