SCHEMBL1726595

SCHEMBL1726595

CC(C)=NOc1cc(C(F)(F)F)ccc1OC1C2CCC1CN(c1ccc(C#N)cn1)C2

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 3/20 0.37
HCRTR2 O43614 3/20 0.37
SGPL1 O95470 2/20 0.37
SMO Q99835 1/20 0.37
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
GPR119 Q8TDV5 2/20 0.36
RET P07949 2/20 0.34
PDE4B Q07343 1/20 0.34
PANK3 Q9H999 2/20 0.34
ACACB O00763 1/20 0.34
GPR6 P46095 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ABL1 P00519 1/20 0.33
LMNA P02545 1/20 0.33
MAOB P27338 1/20 0.33
TIPARP Q7Z3E1 1/20 0.33

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
SCHEMBL12243614 1.00 HCRTR1 (0.37) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL1726594 1.00 HCRTR1 (0.37) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL12222746 0.88 GPR119 (0.37) DPP4DPP8DPP9DPP7GPR119
SCHEMBL12243613 0.86 SMO (0.40) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL2306272 0.85 SMO (0.41) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL12243612 0.85 SMO (0.41) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL2306268 0.85 SMO (0.41) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL2301481 0.84 SMO (0.42) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL2301483 0.84 SMO (0.42) HCRTR1HCRTR2SGPL1SMODPP4
SCHEMBL12244267 0.84 SMO (0.42) HCRTR1HCRTR2SGPL1SMODPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1932844-B1 CROSS-LINKED CYCLIC AMINE COMPOUNDS AND AGENTS FOR PEST CONTROL NIPPON SODA CO (JP) 2015-09-02 EP disclosed
US-8697867-B2 Cross-linked cyclic amine compounds and agents for pest control NIPPON SODA CO., LTD. (JP) 2014-04-15 US disclosed
US-20130331569-A1 CROSS-LINKED CYCLIC AMINE COMPOUNDS AND AGENTS FOR PEST CONTROL NIPPON SODA CO., LTD. (JP) 2013-12-12 US disclosed
US-8536340-B2 Cross-linked cyclic amine compounds and agents for pest control NIPPON SODA CO., LTD. (JP) 2013-09-17 US disclosed
US-8338607-B2 Cyclic amine compounds and agents for pest control NIPPON SODA CO., LTD. (JP) 2012-12-25 US disclosed
EP-1947098-B1 CYCLIC AMINE COMPOUNDS AND PEST CONTROL AGENT NIPPON SODA CO (JP) 2011-11-30 EP disclosed
US-20110257389-A1 CROSS-LINKED CYCLIC AMINE COMPOUNDS AND AGENTS FOR PEST CONTROL NIPPON SODA CO., LTD. (JP) 2011-10-20 US disclosed
US-7999102-B2 Cross-linked cyclic amine compounds and agents for pest control NIPPON SODA CO., LTD. (JP) 2011-08-16 US disclosed
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-12-24 US disclosed
US-20090259046-A1 Cyclic Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-10-15 US disclosed
EP-1947098-A1 CYCLIC AMINE COMPOUNDS AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-07-23 EP disclosed
EP-1932844-A1 BRIDGED CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-06-18 EP 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 (4 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-20110257389-A1 CROSS-LINKED CYCLIC AMINE COMPOUNDS AND AGENTS FOR PEST CONTROL CYCS, NPY1R, CYBB HCRTR1 84/4885HCRTR2 105/4885SGPL1 2579/4885
US-20090259046-A1 Cyclic Amine Compounds and Agents for Pest Control NPR1, CYCS, CYC1 HCRTR1 115/4885HCRTR2 491/4885SGPL1 1689/4885
US-20130331569-A1 CROSS-LINKED CYCLIC AMINE COMPOUNDS AND AGENTS FOR PEST CONTROL CYCS, NPY1R, CYBB HCRTR1 84/4885HCRTR2 105/4885SGPL1 2579/4885
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control CYCS, NPY1R, CYBB HCRTR1 100/4885HCRTR2 156/4885SGPL1 2460/4885

“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.