SCHEMBL13036992

SCHEMBL13036992

CC[C@@H]1CCCN(C(=O)C(F)(F)F)C1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 1/20 0.46
DPP7 Q9UHL4 1/20 0.46
EPHX2 P34913 1/20 0.40
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HPGDS O60760 1/20 0.36
HSD11B1 P28845 1/20 0.36
GRM5 P41594 2/20 0.35

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
SCHEMBL13755136 1.00 DPP8 (0.46) DPP8DPP7EPHX2KMT2AMEN1
SCHEMBL13472123 0.85 DPP8 (0.38) DPP8DPP7EPHX2KMT2AMEN1
SCHEMBL2069876 0.85 EPHX2 (0.52) EPHX2KMT2AMEN1POLBMAPT
SCHEMBL13748096 0.83 DPP8 (0.38) DPP8DPP7EPHX2KMT2AMEN1
SCHEMBL13754851 0.79 EPHX1 (0.47) DPP8DPP7EPHX2EPHX1
SCHEMBL9921219 0.79 CYP4F2 (0.40) DPP8DPP7EPHX2KMT2AMEN1
SCHEMBL12683452 0.79 CYP4F2 (0.40) DPP8DPP7EPHX2KMT2AMEN1
SCHEMBL28539789 0.79 DPP8 (0.40) DPP8DPP7EPHX2KMT2AMEN1
SCHEMBL18331515 0.79 CYP4F2 (0.40) DPP8DPP7EPHX2KMT2AMEN1
SCHEMBL28435515 0.79 DPP8 (0.40) DPP8DPP7EPHX2KMT2AMEN1

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-7825112-B2 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-11-02 US disclosed
US-7825112-B2 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-11-02 US disclosed
US-20090018117-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-01-15 US disclosed
US-20090018117-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-01-15 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-20090018117-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF PKD2, QPCT, CCNT2 DPP8 529/4885DPP7 101/4885EPHX2 2527/4885

“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.