SCHEMBL5685244

SCHEMBL5685244

CC1CCCc2cc[c]cc21

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
IDO1 P14902 2/20 0.33
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL814820 0.88 PDPK1 (0.33) HTR2AHTR2CHTR2B
SCHEMBL4812053 0.85 CHRNB2 (0.30) CHRNB2CHRNA4IDO1HTR2AHTR2C
SCHEMBL1451835 0.80 CHRNB2 (0.55) CHRNB2CHRNA4IDO1
SCHEMBL1451058 0.79 PGR (0.36) CHRNB2CHRNA4IDO1
SCHEMBL1451592 0.79 IDO1 (0.40) CHRNB2CHRNA4IDO1
SCHEMBL1450520 0.75 ESR1 (0.35)
SCHEMBL15147106 0.74 IDO1 (0.53) IDO1HTR2AHTR2CHTR2B
SCHEMBL29977975 0.74 IDO1 (0.53) IDO1HTR2AHTR2CHTR2B
SCHEMBL321745 0.74 IDO1 (0.53) IDO1HTR2AHTR2CHTR2B
SCHEMBL5688182 0.72 HTR2A (0.32) HTR2AHTR2CHTR2B

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-20060122064-A1 Amides and method for plant diseases control with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-06-08 US disclosed
EP-1640360-A1 AMIDES AND METHOD FOR PLANT DISEASE CONTROL WITH THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-03-29 EP 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-20060122064-A1 Amides and method for plant diseases control with the same ARG1, ARGLU1, ARG2 CHRNB2 3031/4885CHRNA4 2868/4885IDO1 2744/4885

“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.