SCHEMBL6019191

SCHEMBL6019191

CCCC(CCC)C(=O)NC(Cc1csc2ccccc12)C(=O)N(C#N)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.50
CTSS P25774 1/20 0.50
CTSK P43235 1/20 0.50
MMP2 P08253 2/20 0.48
MMP9 P14780 2/20 0.48
MMP8 P22894 2/20 0.48
HDAC3 O15379 2/20 0.40
HDAC4 P56524 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
MMP1 P03956 1/20 0.39
MMP3 P08254 1/20 0.39
MMP14 P50281 1/20 0.39
MMP25 Q9NPA2 1/20 0.39
TACR1 P25103 1/20 0.39
KLKB1 P03952 3/20 0.38
KLK1 P06870 2/20 0.38
DPP4 P27487 2/20 0.37
DPP8 Q6V1X1 2/20 0.37

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
SCHEMBL6020164 0.89 MMP2 (0.48) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6020064 0.87 CTSS (0.52) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6019597 0.86 CTSL (0.56) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6020737 0.85 CTSL (0.51) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6021165 0.84 CTSL (0.54) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6019753 0.84 CTSL (0.52) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6020320 0.83 CTSL (0.48) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6021378 0.83 CTSS (0.70) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6020938 0.83 CTSL (0.55) CTSLCTSSCTSKMMP2MMP9
SCHEMBL6020752 0.83 CTSL (0.50) CTSLCTSSCTSKMMP2MMP9

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 1 patent. 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 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 CTSL 2274/4885CTSS 2720/4885CTSK 2529/4885

“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.