SCHEMBL21168302

SCHEMBL21168302

NC(=O)CCC[C@H](N)c1noc(CNC(=O)N[C@@H](CCC(N)=O)C(=O)O)n1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 9/20 0.37
KMT2A Q03164 1/20 0.35
VSIR Q9H7M9 2/20 0.35
CD274 Q9NZQ7 1/20 0.35
NAALAD2 Q9Y3Q0 2/20 0.34
RIMKLA Q8IXN7 1/20 0.34
CA2 P00918 4/20 0.34
CA1 P00915 3/20 0.34
C3AR1 Q16581 1/20 0.33
JAK2 O60674 1/20 0.33

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
SCHEMBL21168361 0.96 FOLH1 (0.41) FOLH1NAALAD2RIMKLA
SCHEMBL21168306 0.96 KMT2A (0.36) FOLH1KMT2AVSIRCD274NAALAD2
SCHEMBL21168304 0.93 FOLH1 (0.42) FOLH1NAALAD2RIMKLA
SCHEMBL21168324 0.92 FOLH1 (0.44) FOLH1VSIRCD274C3AR1
SCHEMBL21999116 0.92 VSIR (0.36) FOLH1KMT2AVSIRCD274NAALAD2
SCHEMBL24058479 0.91 VSIR (0.43) FOLH1KMT2AVSIRCD274NAALAD2
SCHEMBL24058887 0.91 VSIR (0.39) FOLH1KMT2AVSIRCD274NAALAD2
SCHEMBL25477024 0.91 VSIR (0.35) FOLH1KMT2AVSIRCD274NAALAD2
SCHEMBL21168314 0.90 FOLH1 (0.44) FOLH1VSIRCD274C3AR1
SCHEMBL19969099 0.89 VSIR (0.39) FOLH1KMT2AVSIRCD274CA2

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-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2019-07-18 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-20190218252-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling CD47, HIF1AN, PIK3R5 FOLH1 3156/4885KMT2A 2453/4885VSIR 2535/4885

“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.