SCHEMBL6020566

SCHEMBL6020566

N#CCCNC(=O)C(Cc1ccccc1)NC(=O)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.66
EPHX2 P34913 7/20 0.56
MAPK1 P28482 1/20 0.54
EPHX1 P07099 1/20 0.52
CTSS P25774 4/20 0.49
CTSK P43235 2/20 0.49
CYP2D6 P10635 1/20 0.48
MAPT P10636 1/20 0.48
CTSL P07711 4/20 0.47
CTSB P07858 2/20 0.47
LMNA P02545 1/20 0.46
CPB2 Q96IY4 1/20 0.46

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
SCHEMBL6020635 0.92 F10 (0.63) F10EPHX2MAPK1EPHX1CTSS
SCHEMBL6020644 0.91 F10 (0.58) F10EPHX2MAPK1EPHX1CTSS
SCHEMBL6021308 0.88 F10 (0.56) F10EPHX2MAPK1EPHX1CTSS
SCHEMBL6020484 0.83 CTSL (0.57) F10EPHX2CTSSCTSKCTSL
SCHEMBL6020673 0.82 EPHX2 (0.61) F10EPHX2CTSSCTSKCTSL
SCHEMBL6020454 0.82 CTSL (0.51) F10EPHX2MAPK1EPHX1CTSS
SCHEMBL6021138 0.82 ANPEP (0.66) CTSSCTSKCTSLCTSB
SCHEMBL6019472 0.81 CTSB (0.60) F10EPHX2MAPK1CTSSCTSK
SCHEMBL6021503 0.80 EPHX2 (0.45) F10EPHX2EPHX1LMNA
SCHEMBL6445458 0.79 KMT2A (0.67) F10CTSSCTSKCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060252813-A1 Apparatus for curing a composite laminate JERINI AG (DE) 2006-11-09 US claimed
WO-2004056755-A2 COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES JERENI AG (DE) 2004-07-08 WO claimed
EP-1433778-A1 Use of nitriles as rotamase inhibitors Jerini AG (DE) 2004-06-30 EP claimed
EP-1433779-A1 Use of nitriles as inhibitors of non-proteolytic enzymes Jerini AG (DE) 2004-06-30 EP claimed
US-20060252813-A1 Apparatus for curing a composite laminate JERINI AG (DE) 2006-11-09 US disclosed
EP-1575903-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES Jerini AG (DE) 2005-09-21 EP disclosed
WO-2004065353-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES JERINI AG (DE) 2004-08-05 WO disclosed
WO-2004056755-A2 COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES JERENI AG (DE) 2004-07-08 WO disclosed
EP-1433778-A1 Use of nitriles as rotamase inhibitors Jerini AG (DE) 2004-06-30 EP disclosed
EP-1433779-A1 Use of nitriles as inhibitors of non-proteolytic enzymes Jerini AG (DE) 2004-06-30 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 (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-20060252813-A1 Apparatus for curing a composite laminate DHX29, HDHD5, DHRS9 F10 2907/4885EPHX2 8/4885MAPK1 4315/4885

“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.