SCHEMBL2924876

SCHEMBL2924876

CC(C)N1CCN(C(=O)C2CCC(Oc3ccc(N4CCOC4=O)cc3)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.47
LMNA P02545 2/20 0.41
ACACB O00763 1/20 0.41
POLB P06746 1/20 0.41
MMP2 P08253 1/20 0.40
MMP13 P45452 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL2924878 1.00 HRH3 (0.47) HRH3LMNAACACBPOLBMMP2
SCHEMBL2925216 0.86 HRH3 (0.50) HRH3ACACBMMP2MMP13
SCHEMBL2925946 0.86 HRH3 (0.50) HRH3ACACBMMP2MMP13
SCHEMBL2927127 0.84 HRH3 (0.48) HRH3
SCHEMBL2927128 0.84 HRH3 (0.48) HRH3
SCHEMBL2923294 0.83 HRH3 (0.54) HRH3ACACBKMT2A
SCHEMBL2927778 0.83 HRH3 (0.50) HRH3LMNAACACBPOLBMAPT
SCHEMBL2923295 0.83 HRH3 (0.54) HRH3ACACBKMT2A
SCHEMBL2927776 0.83 HRH3 (0.50) HRH3LMNAACACBPOLBMAPT
SCHEMBL2924527 0.82 HRH3 (0.52) HRH3LMNAMAPTKMT2A

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
EP-2158189-B1 CYCLOHEXYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-09-15 EP claimed
US-7544683-B2 Cyclohexyl derivatives HOFFMANN-LA ROCHE INC. (US) 2009-06-09 US claimed
US-20090005380-A1 CYCLOHEXYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-01 US claimed
EP-2158189-B1 CYCLOHEXYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-09-15 EP disclosed
US-7544683-B2 Cyclohexyl derivatives HOFFMANN-LA ROCHE INC. (US) 2009-06-09 US disclosed
US-20090005380-A1 CYCLOHEXYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-01 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-20090005380-A1 CYCLOHEXYL DERIVATIVES HRH3, HRH4, HCAR2 HRH3 1/4885LMNA 2554/4885ACACB 1771/4885

“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.