SCHEMBL12388488

SCHEMBL12388488

Cc1cc(CO)ccc1-c1ccccc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.43
CHEK1 O14757 1/20 0.40
MBNL1 Q9NR56 1/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
RORC P51449 1/20 0.38
ACHE P22303 1/20 0.38
DHODH Q02127 2/20 0.37
ESR2 Q92731 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL10088552 0.85 PPARG (0.44) PDK2CHEK1ESR2L3MBTL1PPARG
SCHEMBL4919837 0.83 ESR2 (0.43) PDK2CHEK1CYP4F2CYP4A11RORC
SCHEMBL18554678 0.81 HTR7 (0.51)
SCHEMBL12388135 0.81 CYP4F2 (0.41) CYP4F2CYP4A11RORCPTGS1PTGS2
SCHEMBL18554697 0.80 ENPP2 (0.39) MBNL1ACHECYP11B1CYP11B2L3MBTL1
SCHEMBL15413958 0.78 ESR2 (0.60) RORCESR2L3MBTL1ALDH1A1PPARG
SCHEMBL21753319 0.77 MKNK1 (0.42) PDK2CHEK1RORCDHODHPPARG
SCHEMBL13652498 0.76 PPARA (0.41) CYP4F2CYP4A11RORCPPARA
SCHEMBL9826815 0.76 KIF11 (0.54) PDK2PTGS1L3MBTL1ALDH1A1MAPT
SCHEMBL14850866 0.76 ELANE (0.45) PDK2MBNL1ACHEDHODHL3MBTL1

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-8748462-B2 Spirocyclic GPR40 modulators AMGEN INC. (US) 2014-06-10 US disclosed
US-20110190330-A1 SPIROCYCLIC GPR40 MODULATORS AMGEN INC. (US) 2011-08-04 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-20110190330-A1 SPIROCYCLIC GPR40 MODULATORS GPR119, GPR55, GPR65 PDK2 953/4885CHEK1 4232/4885MBNL1 2336/4885

“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.