SCHEMBL8310083

SCHEMBL8310083

CNC(CC1CCCCC1)C(C)=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.43
CTSL P07711 5/20 0.40
CTSB P07858 5/20 0.40
CTSH P09668 2/20 0.40
GRN P28799 1/20 0.40
SORT1 Q99523 1/20 0.40
CTSS P25774 2/20 0.40
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38
LTA4H P09960 1/20 0.37
CPB2 Q96IY4 1/20 0.36

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
SCHEMBL12727416 1.00 CTSK (0.43) CTSKCTSLCTSBCTSHGRN
SCHEMBL10442075 1.00 CTSK (0.43) CTSKCTSLCTSBCTSHGRN
SCHEMBL20342111 0.98 CTSK (0.41) CTSKCTSLCTSBCTSHGRN
SCHEMBL12220087 0.98 CTSK (0.41) CTSKCTSLCTSBCTSHGRN
SCHEMBL13909105 0.98 CTSK (0.41) CTSKCTSLCTSBCTSHGRN
SCHEMBL14898377 0.94 CTSK (0.37) CTSKCTSLCTSBCTSHGRN
SCHEMBL12220084 0.94 CTSK (0.37) CTSKCTSLCTSBCTSHGRN
SCHEMBL13127846 0.94 CTSK (0.37) CTSKCTSLCTSBCTSHGRN
SCHEMBL24233279 0.90 GRN (0.36) CTSKCTSLCTSBCTSHGRN
SCHEMBL8291760 0.90 GRN (0.36) CTSKCTSLCTSBCTSHGRN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3535397-B1 ALPHA-V BETA-6 INTEGRIN LIGANDS AND USES THEREOF ARROWHEAD PHARMACEUTICALS INC (US) 2022-01-05 EP disclosed
US-9340575-B2 Agonists and antagonists of the urotensinergic system INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2016-05-17 US disclosed
US-20140113872-A1 NOVEL AGONISTS AND ANTAGONISTS OF THE UROTENSINERGIC SYSTEM INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2014-04-24 US disclosed
EP-1603598-B1 RADIOLABELED CONJUGATES BASED ON SUBSTANCE P AND THE USES THEREOF UNIVERSITAETSSPITAL BASEL (CH) 2008-10-08 EP disclosed
US-20070053837-A1 Radiopharmaceuticals for cancer diagnosis and treatment KANTONSSPITAL BASEL (CH) 2007-03-08 US disclosed
US-20070053837-A1 Radiopharmaceuticals for cancer diagnosis and treatment KANTONSSPITAL BASEL (CH) 2007-03-08 US disclosed
WO-2004089297-A2 COMPOUNDS AND METHODS FOR TREATMENT OF THROMBOSIS SUNTORY PHARMACEUTICAL RESEARCH LABORATORIES, LLC (US) 2004-10-21 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-20140113872-A1 NOVEL AGONISTS AND ANTAGONISTS OF THE UROTENSINERGIC SYSTEM UTS2R, SCTR, PLAUR CTSK 556/4885CTSL 150/4885CTSB 501/4885
US-20070053837-A1 Radiopharmaceuticals for cancer diagnosis and treatment TACR1, GRPR, SSTR1 CTSK 294/4885CTSL 390/4885CTSB 357/4885

“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.