SCHEMBL6035523

SCHEMBL6035523

CCOc1nn(-c2ccc(C(F)(F)F)cn2)cc1CCCOc1ccc(C(C)(C)C(=O)O)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 1/20 0.39
PPARA Q07869 7/20 0.38
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.37
PPARD Q03181 5/20 0.37
PPARG P37231 4/20 0.37
DGAT1 O75907 2/20 0.36
GCGR P47871 2/20 0.36
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
GCG P01275 1/20 0.34

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
SCHEMBL6036243 0.91 PPARA (0.46) SMN1; SMN2KDM4EHPGDPPARAPPARD
SCHEMBL6034816 0.91 CYP4F2 (0.41) SMN1; SMN2KDM4EHPGDPPARALMNA
SCHEMBL6035136 0.88 PPARA (0.40) SMN1; SMN2HPGDPPARANPC1MAPT
SCHEMBL1634400 0.85 PPARA (0.40) SMN1; SMN2KDM4EHPGDPPARALMNA
SCHEMBL6255315 0.84 SMN1; SMN2 (0.41) SMN1; SMN2KDM4EHPGDNPC1MAPT
SCHEMBL6034684 0.84 SMN1; SMN2 (0.43) SMN1; SMN2KDM4EHPGDPPARANPC1
SCHEMBL1633062 0.84 PPARG (0.41) SMN1; SMN2KDM4EPPARALMNAPPARD
SCHEMBL6035632 0.83 PPARA (0.42) SMN1; SMN2KDM4EHPGDPPARANPC1
SCHEMBL6035713 0.82 PPARG (0.43) PPARAPPARDPPARGGCGR
SCHEMBL6035914 0.82 PPARG (0.43) PPARAPPARDPPARGGCGR

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 1 patent. 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

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 SMN1; SMN2 4408/4885KDM4E 509/4885HPGD 3297/4885

“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.