SCHEMBL4037665

SCHEMBL4037665

CCCC(NC(=O)c1ccc(OC(F)(F)F)cc1)C(=O)N1CCC2C1C(=O)CN2S(=O)(=O)c1cccnc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CTSK P43235 3/20 0.42
ABL1 P00519 9/20 0.38
MAPT P10636 1/20 0.37
HSD17B10 Q99714 1/20 0.37
AHR P35869 1/20 0.37
ELOVL6 Q9H5J4 1/20 0.36
GPR132 Q9UNW8 1/20 0.36
NAMPT P43490 1/20 0.35
CTSL P07711 1/20 0.35
CTSS P25774 1/20 0.35
PDE2A O00408 1/20 0.35

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
SCHEMBL4039854 0.92 CTSK (0.51) LMNAHTTSMN1; SMN2CTSKABL1
SCHEMBL4042400 0.92 LMNA (0.43) LMNACTSKMAPTHSD17B10ELOVL6
SCHEMBL4041799 0.92 CTSK (0.45) CTSKMAPTHSD17B10ELOVL6CTSL
SCHEMBL4043930 0.91 CTSK (0.41) LMNAHTTSMN1; SMN2CTSKMAPT
SCHEMBL4043768 0.90 CTSK (0.42) LMNAHTTSMN1; SMN2CTSKABL1
SCHEMBL4040503 0.90 CTSK (0.44) LMNACTSKMAPTHSD17B10ELOVL6
SCHEMBL4040275 0.90 CTSK (0.40) LMNAHTTSMN1; SMN2CTSKABL1
SCHEMBL4040210 0.89 CTSK (0.53) LMNAHTTCTSKMAPTHSD17B10
SCHEMBL4045971 0.89 CTSK (0.43) LMNAHTTSMN1; SMN2CTSKMAPT
SCHEMBL4045239 0.88 CTSK (0.42) CTSKELOVL6CTSLCTSS

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-1546150-B1 PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2009-03-04 EP claimed
US-20060100431-A1 Biologically active compounds AMURA THERAPEUTICS LIMITED (GB) 2006-05-11 US claimed
EP-1546150-A1 BIOLOGICALLY ACTIVE COMPOUNDS Amura Therapeutics Limited (GB) 2005-06-29 EP claimed
WO-2004007501-A1 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2004-01-22 WO claimed
EP-1506175-B1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-04-01 EP disclosed
EP-1546150-B1 PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2009-03-04 EP disclosed
US-20060100431-A1 Biologically active compounds AMURA THERAPEUTICS LIMITED (GB) 2006-05-11 US disclosed
EP-1546150-A1 BIOLOGICALLY ACTIVE COMPOUNDS Amura Therapeutics Limited (GB) 2005-06-29 EP disclosed
WO-2004007501-A1 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2004-01-22 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-20060100431-A1 Biologically active compounds SOST, CTSK, CTSS LMNA 3686/4885HTT 2905/4885SMN1; SMN2 3546/4885

“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.