SCHEMBL14028674

SCHEMBL14028674

CC(C)C[C@H](N)C(=O)NC(Cc1cnc[nH]1)C(=O)N1CCCC1C

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.51
▸ TRHR P34981 1/20 0.50
▸ REN P00797 11/20 0.49
▸ CTSD P07339 1/20 0.47
▸ LNPEP Q9UIQ6 3/20 0.46
▸ ACE2 Q9BYF1 1/20 0.46
▸ ANPEP P15144 1/20 0.44
▸ DPP7 Q9UHL4 1/20 0.44

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
SCHEMBL4959538 0.89 TRHR (0.64) DPP4TRHRRENCTSDLNPEP
SCHEMBL8256978 0.89 TRHR (0.51) DPP4TRHRRENCTSDLNPEP
SCHEMBL14028673 0.84 TRHR (0.54) DPP4TRHRRENCTSDLNPEP
SCHEMBL15381913 0.80 RAMP3 (0.46) RENCTSD
SCHEMBL21828702 0.79 CYP3A4 (0.57) RENLNPEPACE2
SCHEMBL30595016 0.79 CYP3A4 (0.57) RENLNPEPACE2
SCHEMBL19345095 0.78 TRHR (0.61) TRHRRENCTSDLNPEP
SCHEMBL14028661 0.77 TRHR (0.78) DPP4TRHRACE2
SCHEMBL29349749 0.76 CYP3A4 (0.53) RENLNPEPACE2
SCHEMBL4264574 0.75 LNPEP (0.58) TRHRRENCTSDLNPEPANPEP

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-20080249028-A1 Thyrotropin-Releasing Hormone Analogs and Method of Use ROGER WILLIAMS HOSPITAL (US) 2008-10-09 — — 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-20080249028-A1 Thyrotropin-Releasing Hormone Analogs and Method of Use TRHR, IAPP, TRHDE DPP4 81/4885TRHR 1/4885REN 426/4885

“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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