SCHEMBL6629090

SCHEMBL6629090

CCC(C)N1CCC(O)C1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.44
HRH3 Q9Y5N1 2/20 0.36
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
SHBG P04278 1/20 0.34
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL12073908 1.00 DPP4 (0.44) DPP4HRH3DRD2DRD3SHBG
SCHEMBL24800361 1.00 DPP4 (0.44) DPP4HRH3DRD2DRD3SHBG
SCHEMBL6628147 0.88 DRD2 (0.42) DPP4HRH3DRD2DRD3SHBG
SCHEMBL23114447 0.88 DRD2 (0.42) DPP4HRH3DRD2DRD3SHBG
SCHEMBL23467613 0.88 DRD2 (0.42) DPP4HRH3DRD2DRD3SHBG
SCHEMBL23707129 0.88 DRD2 (0.42) DPP4HRH3DRD2DRD3SHBG
SCHEMBL25147322 0.88 DRD2 (0.42) DPP4HRH3DRD2DRD3SHBG
SCHEMBL23707130 0.88 DRD2 (0.42) DPP4HRH3DRD2DRD3SHBG
SCHEMBL23114309 0.87 SHBG (0.41) DPP4HRH3SHBGKDM4E
SCHEMBL23467566 0.87 SHBG (0.41) DPP4HRH3SHBGKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7777041-B2 2-acylamino-4-phenylthiazole derivatives, preparation thereof and therapeutic application thereof SANOFI-AVENTIS (FR) 2010-08-17 US disclosed
US-20090156574-A1 2-ACYLAMINO-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-06-18 US disclosed
US-7504511-B2 2-acylamino-4-phenylthiazole derivatives, preparation thereof and therapeutic application thereof SANOFI-AVENTIS (FR) 2009-03-17 US disclosed
EP-0974602-B1 Catalyst and process for hydrogenating olefinically unsaturated compound JSR CORP (JP) 2004-01-02 EP disclosed
US-6291596-B1 CONTACTING OLEFINICALLY UNSATURATED COMPOUND WITH HYDROGEN IN THE PRESENCE OF A HYDROGENATION CATALYST COMPRISING TITANIUM OR ZIRCONIUM OR HAFNIUM COMPOUND IN AN INERT, ORGANIC SOLVENT JSR CORPORATION (JP) 2001-09-18 US disclosed
EP-0974602-A1 Catalyst and process for hydrogenating olefinically unsaturated compound JSR Corporation (JP) 2000-01-26 EP 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-20090156574-A1 2-ACYLAMINO-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF PAH, ABAT, AADAT DPP4 23/4885HRH3 1058/4885DRD2 4471/4885

“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.