SCHEMBL13249282

SCHEMBL13249282

FC(F)(F)Oc1cccc(C[PH](c2ccccc2)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.46
CETP P11597 11/20 0.45
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
TACR1 P25103 1/20 0.43
DAO P14920 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42
KIF11 P52732 1/20 0.42
DRD4 P21917 1/20 0.41
CNR1 P21554 1/20 0.41

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
SCHEMBL8203246 0.82 GRIN2B (0.47) KIF11
SCHEMBL13249281 0.81 MEP1B (0.44) CETPDAO
SCHEMBL27266886 0.80 KDM4E (0.45)
SCHEMBL5973660 0.79 MAOB (0.57) CHRM2CHRM1CHRM3
Hydrochloric Acid SCHEMBL4176842 0.78 MAOB (0.56) CHRM2CHRM1CHRM3
Bromide SCHEMBL29076665 0.78 MAOB (0.56) CHRM2CHRM1CHRM3
SCHEMBL1044620 0.76 CHRM2 (0.57) MAPK14CETPCHRM2CHRM1CHRM3
SCHEMBL13249283 0.76 BCHE (0.47) CHRM2CHRM1CHRM3
SCHEMBL27484241 0.76 FDFT1 (0.44) CETP
SCHEMBL5009648 0.76 DAO (0.55) MAPK14CETPCHRM2CHRM1CHRM3

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-20100179137-A1 PYRIDONE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-07-15 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-20100179137-A1 PYRIDONE COMPOUND PTGER4, P2RY4, PTGER1 MAPK14 1636/4885CETP 3420/4885CHRM2 499/4885

“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.