SCHEMBL5658068

SCHEMBL5658068

CCN1CCC(COc2cc[c]cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.55
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49

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
SCHEMBL5657330 0.84 CARM1 (0.48) SIGMAR1CARM1PRMT6
SCHEMBL1283169 0.82 AGER (0.45) SIGMAR1HRH3
SCHEMBL751432 0.81 PARP15 (0.50) SIGMAR1
SCHEMBL3989257 0.78 PARP15 (0.53) SIGMAR1
SCHEMBL3575584 0.78 PARP15 (0.53) SIGMAR1
SCHEMBL5655460 0.78 CYP4F2 (0.52) SIGMAR1
SCHEMBL9815661 0.78 PARP15 (0.41) SIGMAR1
SCHEMBL9815659 0.78 PARP15 (0.41) SIGMAR1
SCHEMBL5657345 0.78 HRH3 (0.68) CARM1PRMT6HRH3
SCHEMBL1987414 0.76 PARP10 (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279498-B2 Substituted aryl amides as IP antagonists ROCHE PALO ALTO LLC (US) 2007-10-09 US disclosed
US-6998414-B2 Substituted arylamides as IP antagonists ROCHE PALO ALTO LLC (US) 2006-02-14 US disclosed
EP-1622611-A1 IMIDAZOLIN-2-YLAMINOPHENYL AMIDES AS IP ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-02-08 EP disclosed
US-20060004075-A1 Substituted aryl amides as IP antagonists ROCHE PALO ALTO LLC 2006-01-05 US disclosed
WO-2004096213-A1 IMIDAZOLIN-2-YLAMINOPHENYL AMIDES AS IP ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-11-11 WO disclosed
US-20040220247-A1 Substituted arylamides as IP antagonists ROCHE PALO ALTO LLC 2004-11-04 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 (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-20060004075-A1 Substituted aryl amides as IP antagonists INSR, INSRR, GIPR SIGMAR1 17/4885CARM1 1591/4885PRMT6 2270/4885
US-20040220247-A1 Substituted arylamides as IP antagonists INSR, PTGER1, INSRR SIGMAR1 13/4885CARM1 1874/4885PRMT6 2846/4885

“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.