SCHEMBL17409654

SCHEMBL17409654

CC1CCC=CCN1C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.43
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
ATM Q13315 2/20 0.37
HSD17B10 Q99714 1/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPGD P15428 1/20 0.35
NPC1 O15118 1/20 0.34
TSHR P16473 1/20 0.34
GPR119 Q8TDV5 1/20 0.34

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
SCHEMBL26765821 0.83 PREP (0.41) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL30477339 0.83 PREP (0.41) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL25124058 0.80 CHRM2 (0.36) PREPCHRM2CHRM1CHRM3ATM
SCHEMBL31460207 0.79 PREP (0.39) PREPCHRM2CHRM1CHRM3ATM
SCHEMBL4175218 0.75 CHRM2 (0.44) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL489128 0.75 CHRM2 (0.44) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL489126 0.75 CHRM2 (0.44) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL17664705 0.75 PREP (0.38) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL29866656 0.75 PREP (0.39) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL25165581 0.75 PREP (0.39) PREPCHRM2CHRM1CHRM3HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118647610-A Novel modulators of EHMT1 and EHMT2 and therapeutic uses thereof 探戈医药股份有限公司 2024-09-13 CN disclosed
EP-3459944-B1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY MERCK PATENT GMBH (DE) 2021-01-06 EP disclosed
EP-3459944-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY Merck Patent GmbH (DE) 2019-03-27 EP disclosed
US-9994577-B2 Azepanyl-derivatives and pharmaceutical compositions comprising the same with antiparasitic activity MERCK PATENT GMBH (DE) 2018-06-12 US disclosed
US-9994577-B2 Azepanyl-derivatives and pharmaceutical compositions comprising the same with antiparasitic activity MERCK PATENT GMBH (DE) 2018-06-12 US disclosed
US-20170137428-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY MERCK PATENT GMBH (DE) 2017-05-18 US disclosed
US-20170137428-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY MERCK PATENT GMBH (DE) 2017-05-18 US disclosed
WO-2016000827-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY MERCK PATENT GMBH (DE) 2016-01-07 WO 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-20170137428-A1 AZEPANYL-DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WITH ANTIPARASITIC ACTIVITY ACHE, PARK7, CYP51A1 PREP 740/4885CHRM2 390/4885CHRM1 493/4885

“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.