SCHEMBL12666554

SCHEMBL12666554

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

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.60
HSD11B1 P28845 5/20 0.47
EPHX1 P07099 3/20 0.36
EPHX2 P34913 3/20 0.36
RECQL P46063 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 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
SCHEMBL25689233 0.90 SMN1; SMN2 (0.50) SMN1; SMN2HSD11B1HTT
SCHEMBL25561912 0.85 SMN1; SMN2 (0.61) SMN1; SMN2HSD11B1EPHX1EPHX2RECQL
SCHEMBL26138774 0.82 SMN1; SMN2 (0.40) SMN1; SMN2HSD11B1
SCHEMBL27022615 0.79 SMN1; SMN2 (0.46) SMN1; SMN2PKM
SCHEMBL22677527 0.79 KCNH2 (0.56)
SCHEMBL27812858 0.79 SMN1; SMN2 (0.69) SMN1; SMN2HSD11B1EPHX1EPHX2RECQL
SCHEMBL21099934 0.78 SMN1; SMN2 (0.37) SMN1; SMN2
SCHEMBL12798281 0.78 BCHE (0.44) SMN1; SMN2HSD11B1
SCHEMBL16886298 0.77 EPHX2 (0.46) EPHX1EPHX2GAA
SCHEMBL12156678 0.77 SMN1; SMN2 (0.67) SMN1; SMN2HSD11B1EPHX1EPHX2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11364300-B2 C40-, C28-, and C-32-linked rapamycin analogs as mTOR inhibitors Revolution Medicines, Inc. (US) 2022-06-21 US disclosed
US-20210338824-A1 C40-, C28-, and C-32-Linked Rapamycin Analogs as mTOR Inhibitors WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2021-11-04 US disclosed
US-8809337-B2 Carbamoyl derivatives of bicyclic carbonylamino-pyrazoles as prodrugs NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-08-19 US disclosed
US-8809337-B2 Carbamoyl derivatives of bicyclic carbonylamino-pyrazoles as prodrugs NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-08-19 US disclosed
US-20130203770-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-08-08 US disclosed
US-20130203770-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-08-08 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
US-7897765-B2 Therapeutic compounds and uses thereof ELIXIR PHARMACEUTICALS, INC. (US) 2011-03-01 US disclosed
US-20090264410-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF ELIXIR PHARMACEUTICALS, INC. (US) 2009-10-22 US disclosed
US-7504506-B2 Therapeutic compounds and uses thereof ELIXIR PHARMACEUTICALS, INC. (US) 2009-03-17 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 (5 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-20090264410-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GHSR, GHRHR, GPR119 SMN1; SMN2 3366/4885HSD11B1 197/4885EPHX1 3202/4885
US-20210338824-A1 C40-, C28-, and C-32-Linked Rapamycin Analogs as mTOR Inhibitors MTOR, RICTOR, RPTOR SMN1; SMN2 2014/4885HSD11B1 2929/4885EPHX1 4779/4885
US-11364300-B2 C40-, C28-, and C-32-linked rapamycin analogs as mTOR inhibitors MTOR, RICTOR, RPTOR SMN1; SMN2 2014/4885HSD11B1 2929/4885EPHX1 4779/4885
US-20130203770-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS DMPK, DCK, MAP3K19 SMN1; SMN2 4039/4885HSD11B1 3602/4885EPHX1 3408/4885
US-20110118278-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS DMPK, DCK, MAP3K19 SMN1; SMN2 4039/4885HSD11B1 3602/4885EPHX1 3408/4885

“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.