SCHEMBL6487072

SCHEMBL6487072

C[C@H](N)C(=O)N1CCC[C@]1(C(=O)O)C1(C)CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.36
FAP Q12884 4/20 0.32
DPP7 Q9UHL4 4/20 0.32
DPP8 Q6V1X1 3/20 0.32
DPP9 Q86TI2 3/20 0.32
PITRM1 Q5JRX3 2/20 0.32
PREP P48147 1/20 0.31

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
SCHEMBL7708511 0.79 BACE1 (0.32)
SCHEMBL6559378 0.75 DPP4 (0.37) DPP4FAPDPP7DPP8DPP9
SCHEMBL15756820 0.73 DPP4 (0.38) DPP4FAPDPP7DPP8DPP9
Hydrochloric Acid SCHEMBL7326363 0.71 DPP4 (0.36) DPP4FAPDPP7DPP8DPP9
SCHEMBL11204101 0.70 DPP4 (0.35) DPP4FAPDPP7DPP8DPP9
SCHEMBL11310350 0.70 DPP4 (0.35) DPP4FAPDPP7DPP8DPP9
SCHEMBL7378319 0.70 DPP4 (0.36) DPP4FAPDPP7DPP8DPP9
Hydrochloric Acid SCHEMBL6338693 0.69 DPP4 (0.35) DPP4FAPDPP7DPP8DPP9
SCHEMBL7757818 0.69 DPP4 (0.35) DPP4FAPDPP7DPP8DPP9
SCHEMBL10823665 0.68 DPP4 (0.34) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900319-B2 Thrombin inhibitors ABBOTT GMBH & CO. KG (DE) 2005-05-31 US disclosed
US-20020169318-A1 Novel thrombin inhibitors ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2002-11-14 US disclosed
US-6444817-B1 ANTICOAGULANTS ABBOTT LABORATORIES 2002-09-03 US disclosed
US-6030972-A 2- OR 5-AMINOMETHYL,2- OR 5-CYANOPYRIMIDINES AS INTERMEDIATES OF ANTICOAGULANTS IN EXTRACORPOREAL CIRCULATION (HEART-LUNG MACHINE, HEMODIALYSIS) BASF AKTIENGESELLSCHAFT (DE) 2000-02-29 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-20020169318-A1 Novel thrombin inhibitors TFPI, SERPINC1, F11 DPP4 551/4885FAP 1457/4885DPP7 342/4885

“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.