SCHEMBL3204436

SCHEMBL3204436

[CH2]c1ccc(OC(C)C)cc1Oc1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.55
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 4/20 0.50
HPGD P15428 2/20 0.50
RAB9A P51151 1/20 0.48
FFAR1 O14842 1/20 0.48
LIPE Q05469 1/20 0.47
HTT P42858 1/20 0.46
KMT2A Q03164 2/20 0.46
ATM Q13315 1/20 0.46
MEN1 O00255 1/20 0.45

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
SCHEMBL6901995 0.85 SMN1; SMN2 (0.64) PPARGCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL3209429 0.84 PPARG (0.65) PPARGCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL3202784 0.83 PPARG (0.65) PPARGCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL3220198 0.83 PPARG (0.55) PPARGCYP1A2CYP3A4CYP2C19ALDH1A1
SCHEMBL4599992 0.82 PPARG (0.71) PPARGSMN1; SMN2ALDH1A1LMNA
SCHEMBL3209357 0.82 PPARG (0.56) PPARGCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL4600900 0.81 PPARG (0.53) PPARGCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL3207968 0.80 PPARG (0.68) PPARGSMN1; SMN2LMNAFFAR1
SCHEMBL3207287 0.79 PPARG (0.67) PPARGCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL3205204 0.79 PPARG (0.72) PPARGSMN1; SMN2LMNAFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 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 (3 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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PPARG 31/4885CYP1A2 2418/4885CYP3A4 3701/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 PPARG 30/4885CYP1A2 1645/4885CYP3A4 3275/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PPARG 31/4885CYP1A2 2418/4885CYP3A4 3701/4885

“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.