SCHEMBL16584672

SCHEMBL16584672

CC(C)(C)OC(=O)N1CC2CC2CC1C=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.48
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
PREP P48147 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.34
HSD11B1 P28845 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL609346 1.00 NR1H2 (0.48) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL24909283 1.00 NR1H2 (0.48) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL609610 1.00 NR1H2 (0.48) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL30700601 1.00 NR1H2 (0.48) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL17097458 0.90 NR1H2 (0.44) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL17098157 0.90 NR1H2 (0.44) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL17097460 0.90 NR1H2 (0.44) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL17056975 0.90 NR1H2 (0.44) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL10145613 0.86 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3JAK2
SCHEMBL609152 0.86 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021213353-A1 AMIDE OR SULFONAMIDE DERIVATIVE AND USE THEREOF 苏州恩华生物医药科技有限公司 (CN) 2021-10-28 WO disclosed
US-9181279-B2 Cyclic amine derivatives as EP4 receptor antagonists ROTTAPHARM BIOTECH S.R.L. (IT) 2015-11-10 US disclosed
US-9181279-B2 Cyclic amine derivatives as EP4 receptor antagonists ROTTAPHARM BIOTECH S.R.L. (IT) 2015-11-10 US disclosed
US-9181279-B2 Cyclic amine derivatives as EP4 receptor antagonists ROTTAPHARM BIOTECH S.R.L. (IT) 2015-11-10 US disclosed
EP-2729445-B1 CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Rottapharm Biotech Srl (IT) 2015-10-21 EP disclosed
EP-2729445-B1 CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Rottapharm Biotech Srl (IT) 2015-10-21 EP disclosed
US-20150087626-A1 CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM BIOTECH S.R.L. (IT) 2015-03-26 US disclosed
US-20150087626-A1 CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM BIOTECH S.R.L. (IT) 2015-03-26 US disclosed
US-20150087626-A1 CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM BIOTECH S.R.L. (IT) 2015-03-26 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-20150087626-A1 CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER1, PTGER3 NR1H2 445/4885CHRM2 342/4885CHRM1 348/4885

“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.