SCHEMBL3700799

SCHEMBL3700799

CC1(CO)CCN(c2nc(Cl)nc3ccoc23)CC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SORD Q00796 2/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
PTPN11 Q06124 7/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL3702492 0.86 PTPN11 (0.36) SORDSMN1; SMN2PTPN11
SCHEMBL3711697 0.86 STK4 (0.36) SORDSMN1; SMN2PTPN11ALDH1A1
SCHEMBL3702797 0.80
SCHEMBL3784401 0.78 SCD (0.30)
SCHEMBL1709870 0.78 PDE10A (0.39)
SCHEMBL3716880 0.77 CYP11B2 (0.36) SMN1; SMN2ALDH1A1
SCHEMBL189922 0.76 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1
SCHEMBL3707912 0.76 CYP1A2 (0.38)
SCHEMBL3711359 0.76 PIK3CA (0.37) SMN1; SMN2ALDH1A1
SCHEMBL1709781 0.75 NCF1 (0.43) ALDH1A1

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-8551981-B2 Furo[3,2-d]pyrimidine compounds ABBVIE INC. (US) 2013-10-08 US disclosed
US-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2012-05-17 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-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS CDK2, DPYD, CDK3 SORD 645/4885SMN1; SMN2 4293/4885PTPN11 2780/4885

“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.