SCHEMBL6035503

SCHEMBL6035503

CCCc1c[nH]nc1OCCCc1cn(-c2ccc(C(F)(F)F)cn2)nc1CCC

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
HPGD P15428 1/20 0.33
KDM4E B2RXH2 2/20 0.32
PPARG P37231 3/20 0.32
PPARD Q03181 3/20 0.32
PPARA Q07869 3/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
GCGR P47871 1/20 0.31
SMO Q99835 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
SCHEMBL6034699 0.90 SMN1; SMN2 (0.37) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6035096 0.81 SMN1; SMN2 (0.38) SMN1; SMN2HPGDKDM4EKMT2ALMNA
SCHEMBL6036312 0.81 HCRTR1 (0.36) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6036080 0.80 SMN1; SMN2 (0.36) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6035584 0.80 SMN1; SMN2 (0.37) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6035764 0.79 HCRTR1 (0.36) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6035933 0.78 GAA (0.36) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6034614 0.78 GCGR (0.39) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6036296 0.78 HCRTR1 (0.36) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E
SCHEMBL6034593 0.77 HCRTR1 (0.37) HCRTR1HCRTR2SMN1; SMN2HPGDKDM4E

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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
EP-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 EP disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 WO disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 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 HCRTR1 215/4885HCRTR2 321/4885SMN1; SMN2 4408/4885

“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.