SCHEMBL13233448

SCHEMBL13233448

CC(C)(C)C(=O)N1CCCC1B(O)O

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 17/20 0.75
▸ FAP Q12884 14/20 0.59
▸ DPP7 Q9UHL4 13/20 0.59
▸ DPP8 Q6V1X1 10/20 0.59
▸ DPP9 Q86TI2 9/20 0.59
▸ PREP P48147 8/20 0.59
▸ PITRM1 Q5JRX3 2/20 0.56

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
SCHEMBL7948636 0.79 DPP4 (0.61) DPP4FAPDPP7DPP8DPP9
SCHEMBL15335279 0.79 FAP (0.63) DPP4FAPDPP7DPP8DPP9
SCHEMBL4606763 0.77 DPP4 (0.59) DPP4FAPDPP7DPP8DPP9
SCHEMBL2805719 0.77 DPP4 (0.59) DPP4FAPDPP7DPP8DPP9
SCHEMBL7417676 0.77 DPP4 (0.59) DPP4FAPDPP7DPP8DPP9
SCHEMBL8287969 0.75 DPP4 (0.71) DPP4FAPDPP7DPP8DPP9
SCHEMBL18828991 0.75 DPP4 (1.00) DPP4FAPDPP7DPP8DPP9
SCHEMBL16079845 0.75 DPP4 (1.00) DPP4FAPDPP7DPP8DPP9
SCHEMBL16921202 0.75 DPP4 (1.00) DPP4FAPDPP7DPP8DPP9
SCHEMBL12657193 0.75 DPP4 (1.00) DPP4FAPDPP7DPP8DPP9

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9433594-B2 Technetium- and rhenium-bis(heteroaryl) complexes and methods of use thereof MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2016-09-06 — — US disclosed
US-8962799-B2 Technetium—and rhenium-bis(heteroaryl) complexes and methods of use thereof MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2015-02-24 — — US disclosed
US-20140341805-A1 TECHNETIUM- AND RHENIUM-BIS(HETEROARYL) COMPLEXES AND METHODS OF USE THEREOF MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2014-11-20 — — US disclosed
US-8840865-B2 Technetium- and rhenium-bis(heteroaryl) complexes and methods of use thereof MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2014-09-23 — — US disclosed
US-20140179902-A1 TECHNETIUM- AND RHENIUM-BIS(HETEROARYL) COMPLEXES AND METHODS OF USE THEREOF MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2014-06-26 — — US disclosed
EP-2706057-A1 Bis(imidazolyl)compounds and radionuclide complexes Molecular Insight Pharmaceuticals, Inc. (US) 2014-03-12 — — EP disclosed
US-8562945-B2 Technetium- and rhenium-bis(heteroaryl) complexes and methods of use thereof MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2013-10-22 — — US disclosed
US-20100183509-A1 TECHNETIUM- AND RHENIUM-BIS(HETEROARYL) COMPLEXES AND METHODS OF USE THEREOF MOLECULAR INSIGHT PHARMACEUTICALS, INC. 2010-07-22 — — 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 (3 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-20140341805-A1 TECHNETIUM- AND RHENIUM-BIS(HETEROARYL) COMPLEXES AND METHODS OF USE THEREOF RAB35, SLC39A14, SLC39A3 DPP4 3967/4885FAP 1532/4885DPP7 4022/4885
US-20140179902-A1 TECHNETIUM- AND RHENIUM-BIS(HETEROARYL) COMPLEXES AND METHODS OF USE THEREOF SSTR5, SSTR3, SSTR4 DPP4 1205/4885FAP 250/4885DPP7 1212/4885
US-20100183509-A1 TECHNETIUM- AND RHENIUM-BIS(HETEROARYL) COMPLEXES AND METHODS OF USE THEREOF SSTR5, SSTR3, SSTR4 DPP4 1205/4885FAP 250/4885DPP7 1212/4885

“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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