SCHEMBL12634769

SCHEMBL12634769

Fc1cc(-c2nc(Cl)c3c(n2)CCC3)c(F)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.35
ACHE P22303 11/20 0.35
GRIN1 Q05586 8/20 0.35
GRIN2A Q12879 8/20 0.35
BCHE P06276 7/20 0.35
TP53 P04637 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.32

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
SCHEMBL12634799 0.97 SOS1 (0.38) SOS1ACHEGRIN1GRIN2ABCHE
SCHEMBL12634767 0.91 ACHE (0.36) SOS1ACHEGRIN1GRIN2ABCHE
SCHEMBL12634772 0.86 ACHE (0.35) ACHEGRIN1GRIN2ABCHETP53
SCHEMBL12426347 0.82 ACHE (0.44) SOS1ACHEGRIN1GRIN2ABCHE
SCHEMBL14463345 0.81 ACHE (0.46) SOS1ACHEGRIN1GRIN2ABCHE
SCHEMBL12634796 0.81 CYP1A2 (0.36) CYP1A2
SCHEMBL2200699 0.79 SOS1 (0.45) SOS1ACHEGRIN1GRIN2ABCHE
SCHEMBL7506685 0.78 ACHE (0.46) SOS1ACHEGRIN1GRIN2ABCHE
SCHEMBL1882382 0.78 CYP1A2 (0.33) CYP1A2
SCHEMBL1879354 0.76 CYP1A2 (0.32) CYP1A2

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-7947690-B2 Insulin secretagogue and hypoglycemic agent; pyrimidine derivatives condensed with a non-aromatic ring selected from dihydrothiophene, dihydrofuran, cycloalkane moiety; 1-[2-(4-chloro-2,5-difluorophenyl)-6,6-dioxido-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]-4-(3-hydroxypropyl)piperidin-4-ol for example ASTELLAS PHARMA INC. (JP) 2011-05-24 US disclosed
US-7947690-B2 Insulin secretagogue and hypoglycemic agent; pyrimidine derivatives condensed with a non-aromatic ring selected from dihydrothiophene, dihydrofuran, cycloalkane moiety; 1-[2-(4-chloro-2,5-difluorophenyl)-6,6-dioxido-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]-4-(3-hydroxypropyl)piperidin-4-ol for example ASTELLAS PHARMA INC. (JP) 2011-05-24 US disclosed
US-20080070896-A1 Pyrimidine Derivative Condensed with a Non-Aromatic Ring ASTELLAS PHARMA INC. (JP) 2008-03-20 US disclosed
US-20080070896-A1 Pyrimidine Derivative Condensed with a Non-Aromatic Ring ASTELLAS PHARMA INC. (JP) 2008-03-20 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-20080070896-A1 Pyrimidine Derivative Condensed with a Non-Aromatic Ring GPR119, IRS1, NONO SOS1 2777/4885ACHE 3983/4885GRIN1 1626/4885

“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.