SCHEMBL6035283

SCHEMBL6035283

CCOC(=O)CCc1cn(-c2cc(C(F)(F)F)ccn2)nc1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
FPR2 P25090 2/20 0.37
HRH3 Q9Y5N1 1/20 0.36
SYK P43405 3/20 0.36
ACACB O00763 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
DPP4 P27487 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
FFAR1 O14842 1/20 0.33
KCNN4 O15554 1/20 0.33
GCG P01275 1/20 0.33

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
SCHEMBL6034456 0.86 L3MBTL1 (0.42) L3MBTL1ALDH1A1GAANPSR1FPR2
SCHEMBL6034597 0.85 SMN1; SMN2 (0.47) L3MBTL1ALDH1A1GAAFPR2HRH3
SCHEMBL6035573 0.83 DDX3X (0.41) ALDH1A1FPR2CYP4F2CYP4A11PPARG
SCHEMBL6035729 0.81 NPSR1 (0.42) ALDH1A1NPSR1HRH3ACACBMAPT
SCHEMBL6035870 0.80 SYK (0.40) L3MBTL1ALDH1A1GAANPSR1HRH3
SCHEMBL6035140 0.79 EPHX2 (0.40) ALDH1A1GAAHRH3SYKCYP4F2
SCHEMBL6034508 0.78 SMN1; SMN2 (0.45) L3MBTL1ALDH1A1GAAFPR2HRH3
SCHEMBL6035751 0.77 SMN1; SMN2 (0.45) L3MBTL1ALDH1A1GAAFPR2HRH3
SCHEMBL6036242 0.77 SMN1; SMN2 (0.46) L3MBTL1ALDH1A1GAAFPR2CYP4F2
SCHEMBL6035631 0.76 CYP4F2 (0.38) ALDH1A1GAACYP4F2CYP4A11DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 WO 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 L3MBTL1 1040/4885ALDH1A1 1442/4885GAA 815/4885

“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.