SCHEMBL3638316

SCHEMBL3638316

Cc1nc(N)ncc1-c1ccc(Cl)c(S(=O)(=O)N2CCN(C)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 6/20 0.48
ALOX5AP P20292 5/20 0.48
L3MBTL1 Q9Y468 3/20 0.46
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.42
DHFR P00374 1/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
KCNH2 Q12809 1/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
CCNE2 O96020 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
GSK3B P49841 1/20 0.40
LMNA P02545 1/20 0.40
ABL1 P00519 1/20 0.40

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
SCHEMBL3640630 0.91 ALOX5AP (0.48) FEN1ALOX5APL3MBTL1ALDH1A1POLB
SCHEMBL3643843 0.91 ALOX5AP (0.46) FEN1ALOX5APL3MBTL1ALDH1A1POLB
SCHEMBL3647003 0.89 DHFR (0.39) FEN1ALOX5APALDH1A1DHFRPIK3CD
SCHEMBL3638260 0.89 ALDH1A1 (0.45) FEN1ALOX5APALDH1A1DHFRPIK3CD
SCHEMBL3646170 0.88 ALOX5AP (0.51) FEN1ALOX5APALDH1A1MEN1HTT
SCHEMBL3642925 0.88 FEN1 (0.48) FEN1ALOX5APALDH1A1KCNH2PIK3CA
SCHEMBL3640410 0.86 ALOX5AP (0.48) FEN1ALOX5APALDH1A1DHFRHTT
SCHEMBL3646702 0.85 ALOX5AP (0.50) FEN1ALOX5APDHFRPIK3CDPIK3CA
SCHEMBL3643601 0.79 SMN1; SMN2 (0.48) FEN1ALOX5APL3MBTL1ALDH1A1POLB
SCHEMBL3644204 0.78 PIK3CD (0.55) FEN1ALOX5APDHFRPIK3CDPIK3CA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263585-B2 Organic compounds NOVARTIS AG (CH) 2012-09-11 US disclosed
EP-2173722-B1 PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2012-08-29 EP disclosed
EP-2173722-A2 PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS Novartis Ag (CH) 2010-04-14 EP disclosed
US-20090163463-A1 Organic Compounds NOVARTIS AG 2009-06-25 US disclosed
WO-2009013348-A2 PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2009-01-29 WO 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-20090163463-A1 Organic Compounds PIK3C3, PIK3CA, MTOR FEN1 4194/4885ALOX5AP 3790/4885L3MBTL1 4096/4885

“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.