SCHEMBL25476858

SCHEMBL25476858

CC(=O)C1CCCN1C(=O)NCc1nc([C@@H](N)CCCCN)no1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.34
▸ DPP8 Q6V1X1 3/20 0.34
▸ DPP7 Q9UHL4 3/20 0.34
▸ DPP9 Q86TI2 2/20 0.34
▸ FAP Q12884 1/20 0.34
▸ F2 P00734 2/20 0.34
▸ CYP2C9 P11712 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ ACE P12821 2/20 0.33
▸ FKBP1A P62942 1/20 0.33
▸ ITGB3 P05106 1/20 0.33
▸ ITGA2B P08514 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL21168295 0.92 ACE (0.41) ACE
SCHEMBL21168296 0.92 ACE (0.41) ACE
SCHEMBL21168286 0.91 ACE (0.40) ACE
SCHEMBL25476847 0.88 F2 (0.36) F2CYP2C9CYP2C19CYP3A4PKM
SCHEMBL25476856 0.88 ACE (0.37) DPP4DPP8DPP7DPP9FAP
SCHEMBL21168380 0.82 FKBP1A (0.35) F2CYP2C9CYP2C19CYP3A4PKM
SCHEMBL21168327 0.82 ACE (0.39) CYP2C9CYP2C19CYP3A4PKMACE
SCHEMBL25476852 0.82 CYP3A4 (0.46) F2CYP2C9CYP2C19CYP3A4PKM
SCHEMBL23351345 0.82 FKBP1A (0.34) CYP2C9CYP2C19CYP3A4PKMACE
SCHEMBL21168328 0.80 ACE (0.43) DPP4DPP8DPP7DPP9FAP

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-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways AURIGENE ONCOLOGY LIMITED (IN) 2023-05-11 — — 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-20230144653-A1 1,2,4-Oxadiazole Compounds as Inhibitors of CD47 Signalling Pathways CD47, HIF1AN, PIK3R5 DPP4 4748/4885DPP8 4772/4885DPP7 4729/4885

“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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