SCHEMBL3711697

SCHEMBL3711697

CC1(O)CCN(c2nc(Cl)nc3ccoc23)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK4 Q13043 1/20 0.36
STK3 Q13188 1/20 0.36
PDE10A Q9Y233 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
PTPN11 Q06124 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAT2A P31153 1/20 0.32
ALOX5AP P20292 2/20 0.31
ATR Q13535 1/20 0.31
ATRIP Q8WXE1 1/20 0.31
MALT1 Q9UDY8 1/20 0.31
TACR2 P21452 1/20 0.31
PIK3CA P42336 3/20 0.31
MTOR P42345 2/20 0.31
RAF1 P04049 1/20 0.31
BRAF P15056 1/20 0.31
CNR2 P34972 1/20 0.30
SORD Q00796 1/20 0.30
PDE5A O76074 1/20 0.30
PIK3CD O00329 1/20 0.30

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 0.85 PTPN11 (0.36) SMN1; SMN2PTPN11PIK3CASORDPIK3CD
SCHEMBL25530661 0.82 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1
SCHEMBL189922 0.79 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1PIK3CARAF1BRAF
SCHEMBL3711359 0.78 PIK3CA (0.37) STK4STK3PDE10ASMN1; SMN2ALDH1A1
SCHEMBL1709781 0.78 NCF1 (0.43) ALDH1A1CNR2
SCHEMBL1709783 0.78 HTR2C (0.44)
SCHEMBL3716880 0.77 CYP11B2 (0.36) SMN1; SMN2ALDH1A1
SCHEMBL3784401 0.77 SCD (0.30)
SCHEMBL3702797 0.77
SCHEMBL10269235 0.76 PAK4 (0.43) SMN1; SMN2PTPN11MALT1PIK3CAPIK3CD

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 STK4 395/4885STK3 360/4885PDE10A 1389/4885

“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.