SCHEMBL5657330

SCHEMBL5657330

CN1CCC(COc2cc[c]cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
CXCR1 P25024 1/20 0.47
SIGMAR1 Q99720 3/20 0.47
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45

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
SCHEMBL5658068 0.84 SIGMAR1 (0.55) CARM1PRMT6SIGMAR1
SCHEMBL751432 0.84 PARP15 (0.50) SIGMAR1
SCHEMBL10261333 0.83 CARM1 (0.66) CARM1PRMT6CXCR1
SCHEMBL28898048 0.83 MAOA (0.50) MAOAMAOB
SCHEMBL21009699 0.81 MAOA (0.53) CARM1PRMT6CXCR1SIGMAR1MAOA
SCHEMBL3989257 0.80 PARP15 (0.53) SIGMAR1MAOAMAOB
SCHEMBL3575584 0.80 PARP15 (0.53) SIGMAR1MAOAMAOB
SCHEMBL5655460 0.80 CYP4F2 (0.52) SIGMAR1
SCHEMBL23012677 0.80 ALDH1A1 (0.55) CARM1PRMT6CXCR1MAOAMAOB
SCHEMBL14862577 0.80 CXCR1 (0.50) CARM1PRMT6CXCR1MAOAMAOB

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 4 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
US-20060004075-A1 Substituted aryl amides as IP antagonists ROCHE PALO ALTO LLC 2006-01-05 US 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 CARM1 1591/4885PRMT6 2270/4885CXCR1 480/4885
US-20040220247-A1 Substituted arylamides as IP antagonists INSR, PTGER1, INSRR CARM1 1874/4885PRMT6 2846/4885CXCR1 510/4885

“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.