SCHEMBL22668934

SCHEMBL22668934

CC(C)(C)C(=O)[C@H](CCCNC(N)=O)NC(=O)[C@H](CCO)NC(=O)CCCCCN1C(=O)C=CC1=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 4/20 0.38
▸ NPY5R Q15761 4/20 0.38
▸ NPY1R P25929 3/20 0.38
▸ NPY2R P49146 1/20 0.38
▸ NMT1 P30419 8/20 0.38
▸ NMT2 O60551 7/20 0.38
▸ PTGS1 P23219 4/20 0.37
▸ PTGS2 P35354 4/20 0.37
▸ TLR2 O60603 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
SCHEMBL20340675 0.94 NMT1 (0.43) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL20889000 0.92 NMT1 (0.46) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL23436462 0.92 NMT1 (0.46) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL22668929 0.90 PTGS1 (0.44) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL20935183 0.90 NPY4R (0.36) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL19681474 0.89 NPY5R (0.39) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL18909025 0.88 FAP (0.37) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL22694922 0.88 FAP (0.37) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL22267878 0.88 FAP (0.37) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL22267880 0.87 PTGS1 (0.38) PTGS1PTGS2

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-20200362054-A1 TRISPECIFIC BINDING MOLECULES AGAINST TUMOR-ASSOCIATED ANTIGENTS AND USE THEREOF NOVARTIS AG (CH) 2020-11-19 — — 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-20200362054-A1 TRISPECIFIC BINDING MOLECULES AGAINST TUMOR-ASSOCIATED ANTIGENTS AND USE THEREOF CD2, CD2BP2, CD22 NPY4R 4500/4885NPY5R 4544/4885NPY1R 4516/4885

“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.

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