SCHEMBL3204724

SCHEMBL3204724

COC(=O)c1cc(OC(C)C)nn1Cc1ccc(Cl)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.64
NPC1 O15118 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
USP2 O75604 1/20 0.46
JAK2 O60674 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL5119752 0.85 NPC1 (0.50) PPARGNPC1SMN1; SMN2JAK2ALDH1A1
SCHEMBL3207320 0.83 PPARG (0.58) PPARGNPC1SMN1; SMN2JAK2ALDH1A1
SCHEMBL5107618 0.82 NPC1 (0.54) PPARGNPC1SMN1; SMN2USP2JAK2
SCHEMBL5106653 0.80 SMN1; SMN2 (0.49) PPARGSMN1; SMN2ALDH1A1RAB9AMEN1
SCHEMBL3202480 0.80 PPARG (0.53) PPARGNPC1SMN1; SMN2USP2JAK2
SCHEMBL3211105 0.80 PPARG (0.67) PPARGSMN1; SMN2USP2
SCHEMBL3215481 0.80 PPARG (0.67) PPARGNPC1SMN1; SMN2USP2
SCHEMBL3215461 0.80 PPARG (0.67) PPARGNPC1SMN1; SMN2USP2
SCHEMBL8364840 0.80 NPC1 (0.51) PPARGNPC1SMN1; SMN2JAK2ALDH1A1
SCHEMBL3202595 0.79 PPARG (0.72) PPARGNPC1SMN1; SMN2USP2

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 7 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-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 EP 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 (4 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 31/4885NPC1 1683/4885SMN1; SMN2 3845/4885
US-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 PPARG 52/4885NPC1 2819/4885SMN1; SMN2 3876/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 PPARG 30/4885NPC1 1377/4885SMN1; SMN2 4093/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PPARG 31/4885NPC1 1683/4885SMN1; SMN2 3845/4885

“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.