SCHEMBL5067988

SCHEMBL5067988

CCOC(=O)N1CCC(Nc2ccccc2)(C(N)=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA4 P22748 1/20 0.49
CA5A P35218 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA13 Q8N1Q1 1/20 0.49
CA14 Q9ULX7 1/20 0.49
APP P05067 4/20 0.47
TSHR P16473 2/20 0.47
ABL1 P00519 1/20 0.47
POLB P06746 1/20 0.47
RIN1 Q13671 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
GAA P10253 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL11569029 0.90 MAPT (0.63) MAPTAPPTSHRABL1POLB
SCHEMBL800531 0.88 MAPT (0.58) MAPTAPPTSHRABL1POLB
SCHEMBL11047280 0.88 MAPT (0.48) MAPTABL1POLBRIN1TDP1
SCHEMBL11568412 0.87 MAPT (0.56) MAPTAPPTSHRABL1POLB
SCHEMBL780425 0.86 MAPT (0.62) MAPTAPPTSHRABL1POLB
SCHEMBL13422548 0.84 MAPT (0.53) MAPTAPPTSHRABL1POLB
SCHEMBL13451568 0.83 MAPT (0.52) MAPTAPPTSHRABL1POLB
SCHEMBL14000421 0.82 CA12 (0.55) CA12CA1CA2CA4CA5A
SCHEMBL19690767 0.80 MAPT (0.48) MAPTTSHROPRD1OPRK1
SCHEMBL10274478 0.79 CA12 (0.56) CA12CA1CA2CA4CA5A

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
EP-3643704-B1 NEW INTERMEDIATES FOR THE PREPARATION OF REMIFENTANIL HYDROCHLORIDE HAMELN PHARMA GMBH (DE) 2020-12-16 EP disclosed
US-10844014-B2 Intermediates for the preparation of remifentanil hydrochloride HAMELN PHARMA GMBH (DE) 2020-11-24 US disclosed
US-10844014-B2 Intermediates for the preparation of remifentanil hydrochloride HAMELN PHARMA GMBH (DE) 2020-11-24 US disclosed
US-20200131127-A1 INTERMEDIATES FOR THE PREPARATION OF REMIFENTANIL HYDROCHLORIDE HAMELN PHARMA PLUS GMBH (DE) 2020-04-30 US disclosed
EP-3643704-A1 NEW INTERMEDIATES FOR THE PREPARATION OF REMIFENTANIL HYDROCHLORIDE hameln pharma plus gmbh (DE) 2020-04-29 EP disclosed
US-8946433-B2 Process for the preparation of sufentanil base and related compounds MALLINCKRODT LLC (US) 2015-02-03 US disclosed
WO-2010039260-A2 SPIPERONE DERIVATIVES AND METHODS OF TREATING DISORDERS THE JOHNS HOPKINS UNIVERSITY (US) 2010-04-08 WO disclosed
EP-1984336-A2 PROCESS FOR SYNTHESIZING REMIFENTANIL MALLINCKRODT, INC. (US) 2008-10-29 EP disclosed
WO-2007087164-A2 PROCESS FOR SYNTHESIZING REMIFENTANIL MALLINCKRODT INC. (US) 2007-08-02 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 (2 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-10844014-B2 Intermediates for the preparation of remifentanil hydrochloride OPRK1, OPRM1, OPRD1 MAPT 1537/4885CA12 3856/4885CA1 1965/4885
US-20200131127-A1 INTERMEDIATES FOR THE PREPARATION OF REMIFENTANIL HYDROCHLORIDE OPRK1, OPRM1, OPRD1 MAPT 1537/4885CA12 3856/4885CA1 1965/4885

“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.