SCHEMBL12674136

SCHEMBL12674136

CCN1CCC(C(=O)C(C)C)CC1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.60
HSD11B1 P28845 5/20 0.44
KDM4E B2RXH2 3/20 0.38
EPHX1 P07099 2/20 0.36
EPHX2 P34913 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL23251841 0.90 SMN1; SMN2 (0.50) SMN1; SMN2HSD11B1KDM4EGAA
SCHEMBL25075221 0.90 SMN1; SMN2 (0.50) SMN1; SMN2HSD11B1KDM4EEPHX1EPHX2
SCHEMBL25075072 0.82 SMN1; SMN2 (0.41) SMN1; SMN2
SCHEMBL26455978 0.82 SMN1; SMN2 (0.41) SMN1; SMN2KDM4EALDH1A1GAA
SCHEMBL19267939 0.79 GNAI3 (0.48) SMN1; SMN2
SCHEMBL18117392 0.79 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1GAA
SCHEMBL26452614 0.79 SMN1; SMN2 (0.46) SMN1; SMN2KDM4EALDH1A1GAA
SCHEMBL25075073 0.79 KCNH2 (0.40) SMN1; SMN2ALDH1A1
SCHEMBL19130734 0.79 KCNH2 (0.56)
SCHEMBL19130714 0.79 KCNH2 (0.56)

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
WO-2022081928-A1 TRICYCLIC HETEROBIFUNCTIONAL COMPOUNDS FOR DEGRADATION OF TARGETED PROTEINS C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed
US-20200361944-A1 FRAGMENT SYNTHESIS OF CYCLIC PEPTIDES ZEALAND PHARMA A/S (DK) 2020-11-19 US disclosed
US-20160220637-A1 Pharmaceutical Compositions of Growth Hormone Secretagogue Receptor Ligands IPSEN PHARMA S.A.S. (FR) 2016-08-04 US disclosed
US-20110118278-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-05-19 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 (3 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-20160220637-A1 Pharmaceutical Compositions of Growth Hormone Secretagogue Receptor Ligands GHSR, GHRHR, SSTR5 SMN1; SMN2 3597/4885HSD11B1 1254/4885KDM4E 3946/4885
US-20200361944-A1 FRAGMENT SYNTHESIS OF CYCLIC PEPTIDES VIP, NPPA, NGLY1 SMN1; SMN2 3377/4885HSD11B1 1479/4885KDM4E 4748/4885
US-20110118278-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS DMPK, DCK, MAP3K19 SMN1; SMN2 4039/4885HSD11B1 3602/4885KDM4E 623/4885

“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.