SCHEMBL6347241

SCHEMBL6347241

COC(c1cc[c]cc1)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.43
IDO1 P14902 4/20 0.41
SLC6A2 P23975 2/20 0.37
FPR2 P25090 3/20 0.35
PROKR1 Q8TCW9 3/20 0.35
EPHX1 P07099 2/20 0.33
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL9688143 0.92 SLC6A4 (0.41) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL9685934 0.92 IDO1 (0.43) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL9688096 0.91 IDO1 (0.46) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL19144912 0.79 IDO1 (0.64) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL16979030 0.78 SLC6A4 (0.49) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL744402 0.76 SLC6A4 (0.47) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL4598274 0.76 SLC6A4 (0.47) SLC6A4IDO1SLC6A2FPR2PROKR1
Iodide SCHEMBL744206 0.74 SLC6A4 (0.46) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL18253202 0.73 SLC6A4 (0.45) SLC6A4IDO1SLC6A2FPR2PROKR1
SCHEMBL12066334 0.71 IDO1 (0.68) SLC6A4IDO1SLC6A2FPR2PROKR1

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-20050101783-A1 N-(heterocycle-methyl)alkylamine derivative, process for producing the same, and bactericide KUREHA CORPORATION (JP) 2005-05-12 US disclosed
US-5135932-A 2-HYDROXYPROPYLAMINO-ALKYL-BENZIMIDAZOLY-5-YL DERIVATIVES AND THEIR USE IN THE TREATMENT OF HEART DISEASE DR. KARL THOMAE GMBH (DE) 1992-08-04 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-20050101783-A1 N-(heterocycle-methyl)alkylamine derivative, process for producing the same, and bactericide HBZ, ACMSD, HDHD5 SLC6A4 1729/4885IDO1 135/4885SLC6A2 2605/4885

“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.