SCHEMBL3172352

SCHEMBL3172352

CCCCCCCCNC(=O)CN

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.67
NAAA Q02083 1/20 0.62
EPHX1 P07099 7/20 0.61
FAAH O00519 3/20 0.56
SLC6A5 Q9Y345 2/20 0.56
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
RRM1 P23921 1/20 0.53
ZDHHC20 Q5W0Z9 1/20 0.52
ZDHHC2 Q9UIJ5 1/20 0.52

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
SCHEMBL22776495 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
SCHEMBL1263917 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
SCHEMBL25885398 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
SCHEMBL11246492 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
SCHEMBL11594186 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
SCHEMBL25885394 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
SCHEMBL10708302 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
SCHEMBL29981433 1.00 CASP2 (0.67) CASP2NAAAEPHX1FAAHSLC6A5
Hydrochloric Acid SCHEMBL23001108 0.98 CASP2 (0.64) CASP2NAAAEPHX1FAAHSLC6A5
Hydrochloric Acid SCHEMBL11638490 0.98 CASP2 (0.64) CASP2NAAAEPHX1FAAHSLC6A5

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-20230218765-A1 SMALL MOLECULE DEGRADERS OF SHP2 PROTEIN UNIV MICHIGAN REGENTS (US) 2023-07-13 US disclosed
US-9173956-B2 METAP2 inhibitors and methods of treating obesity SYNDEVRX, INC. (US) 2015-11-03 US disclosed
US-7645805-B2 Gelling agents APPLIED NANOSYSTEMS, B.V. (NL) 2010-01-12 US disclosed
US-20090181037-A1 Semi-Synthetic GLP-1 Peptide-FC Fusion Constructs, Methods and Uses CENTOCOR ORTHO BIOTECH, INC. 2009-07-16 US disclosed
EP-1506168-B1 GELLING AGENTS APPLIED NANOSYSTEMS BV (NL) 2008-04-30 EP disclosed
US-20050250857-A1 Gelling agents NANO FIBER MATRICES B.V. (NL) 2005-11-10 US disclosed
EP-1506168-A2 GELLING AGENTS Applied NanoSystems B.V. (NL) 2005-02-16 EP disclosed
WO-2003097587-A2 GELLING AGENTS APPLIED NANOSYSTEMS B.V. (NL) 2003-11-27 WO disclosed
EP-1364941-A1 Gelling agents Applied NanoSystems B.V. (NL) 2003-11-26 EP disclosed
WO-1996028458-A1 SURFACTANT COMPOSITIONS WITH ANTI-MICROBIAL EFFECT CASTROL LIMITED (GB) 1996-09-19 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-20230218765-A1 SMALL MOLECULE DEGRADERS OF SHP2 PROTEIN PTPN1, PTPRS, PPM1D CASP2 4306/4885NAAA 4123/4885EPHX1 2891/4885
US-20090181037-A1 Semi-Synthetic GLP-1 Peptide-FC Fusion Constructs, Methods and Uses GLP1R, IAPP, GCG CASP2 3067/4885NAAA 2076/4885EPHX1 4391/4885

“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.