SCHEMBL2173563

SCHEMBL2173563

O=C1CC(OCc2ccccc2)CN1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
CTSL P07711 1/20 0.44
CTSB P07858 1/20 0.44
CTSK P43235 1/20 0.44
MAOB P27338 1/20 0.44
LMNA P02545 1/20 0.43
PSEN1 P49768 4/20 0.41
PSEN2 P49810 4/20 0.41
APH1B Q8WW43 4/20 0.41
NCSTN Q92542 4/20 0.41
APH1A Q96BI3 4/20 0.41
PSENEN Q9NZ42 4/20 0.41
HTT P42858 1/20 0.41
OPRM1 P35372 2/20 0.40
OPRL1 P41146 2/20 0.40
DPP4 P27487 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL7420548 1.00 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DCTSL
SCHEMBL7442302 0.90 MAOB (0.55) PDE4APDE4BPDE4CPDE4DMAOB
SCHEMBL19885198 0.84 CARM1 (0.41) MAOBCARM1PRMT6
SCHEMBL18472041 0.84 CARM1 (0.41) MAOBCARM1PRMT6
SCHEMBL21026697 0.84 CARM1 (0.41) MAOBCARM1PRMT6
SCHEMBL425330 0.77 CTSL (0.50) CTSLCTSBCTSKPSEN1PSEN2
SCHEMBL581885 0.74 CTSL (0.51) CTSLCTSBCTSKOPRM1OPRL1
SCHEMBL16699631 0.74 LMNA (0.55) PDE4APDE4BPDE4CPDE4DCTSL
SCHEMBL4059320 0.74 CREBBP (0.45) CTSLCTSBCTSKLMNAPSEN1
SCHEMBL3740260 0.74 HRH1 (0.47) MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247578-B2 Process for production of aralkyloxypyrrolidine derivative KANEKA CORPORATION (JP) 2012-08-21 US disclosed
US-8242285-B2 N-tert-butoxycarbonyl-2-pyrrolidinones and production method thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
US-20110224444-A1 PROCESS FOR PRODUCTION OF ARALKYLOXYPYRROLIDINE DERIVATIVE KANEKA CORPORATION (JP) 2011-09-15 US disclosed
US-7973176-B2 Process for production of aralkyloxypyrrolidine derivative KANEKA CORPORATION (JP) 2011-07-05 US disclosed
EP-1947083-B1 PROCESS FOR PRODUCTION OF ARALKYLOXYPYRROLIDINE DERIVATIVE KANEKA CORP (JP) 2010-11-10 EP disclosed
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-04 US disclosed
US-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-25 US disclosed
CN-101415676-A N-tert-butoxycarbonyl-2-pyrrolidinone compounds and method for producing the same SUMITOMO CHEMICAL CO (JP) 2009-04-22 CN disclosed
EP-2008999-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PROCESS FOR PRODUCING THE SAME Sumitomo Chemical Company, Limited (JP) 2008-12-31 EP disclosed
US-20080306283-A1 Process For Production of Aralkyloxypyrrolidine Derivative KANEKA CORPORATION (JP) 2008-12-11 US disclosed
EP-1947083-A1 PROCESS FOR PRODUCTION OF ARALKYLOXYPYRROLIDINE DERIVATIVE Kaneka Corporation (JP) 2008-07-23 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-20080306283-A1 Process For Production of Aralkyloxypyrrolidine Derivative HPD, HAAO, ARL1 PDE4A 1938/4885PDE4B 2766/4885PDE4C 2200/4885
US-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF TERT, CBR1, TELO2 PDE4A 4686/4885PDE4B 4683/4885PDE4C 4741/4885
US-20110224444-A1 PROCESS FOR PRODUCTION OF ARALKYLOXYPYRROLIDINE DERIVATIVE HPD, HAAO, ARL1 PDE4A 1938/4885PDE4B 2766/4885PDE4C 2200/4885
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof TERT, CBR1, TELO2 PDE4A 4686/4885PDE4B 4683/4885PDE4C 4741/4885

“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.