SCHEMBL4899549

SCHEMBL4899549

O=S(=O)(Nc1ccc(Nc2nccc(-c3cccnc3)n2)cc1)c1ccc(Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 4/20 0.61
CHUK O15111 2/20 0.61
ABL1 P00519 6/20 0.60
PRKCA P17252 4/20 0.60
EGFR P00533 3/20 0.60
PRKCD Q05655 2/20 0.60
BCR P11274 5/20 0.60
PLK1 P53350 1/20 0.57
KIT P10721 2/20 0.56
NAMPT P43490 1/20 0.53
PDGFRB P09619 1/20 0.52
PDGFRA P16234 1/20 0.52
PIK3CA P42336 1/20 0.52
PIK3CB P42338 1/20 0.52
PIK3CG P48736 1/20 0.52
SRC P12931 2/20 0.51
PRKACA P17612 1/20 0.51
PRKACG P22612 1/20 0.51
PRKACB P22694 1/20 0.51
MAPK8 P45983 1/20 0.51

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
SCHEMBL4893321 0.90 ABL1 (0.69) IKBKBCHUKABL1PRKCAEGFR
SCHEMBL4903401 0.89 IKBKB (0.67) IKBKBCHUKPLK1PIK3CAPIK3CB
SCHEMBL4892544 0.87 KIT (0.69) ABL1PRKCAEGFRBCRKIT
SCHEMBL4138273 0.86 ABL1 (0.57) IKBKBABL1PRKCAEGFRPRKCD
SCHEMBL4146725 0.84 ABL1 (0.66) IKBKBABL1PRKCAEGFRPRKCD
SCHEMBL4901606 0.83 IKBKB (0.57) IKBKBCHUKABL1PRKCABCR
SCHEMBL7470673 0.81 IKBKB (0.81) IKBKBABL1PRKCAEGFRPRKCD
SCHEMBL4903409 0.81 IKBKB (0.61) IKBKBCHUKABL1PRKCAPRKCD
SCHEMBL4897551 0.80 ABL1 (0.69) IKBKBABL1PRKCAEGFRPRKCD
SCHEMBL4903706 0.79 PRKCA (0.70) ABL1PRKCAEGFRBCRKIT

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-20080187575-A1 Pyrimidine Derivatives VICHEM CHEMIE KFT (HU) 2008-08-07 US claimed
EP-1786781-A2 PYRIMIDINE DERIVATIVES GPC Biotech AG (DE) 2007-05-23 EP claimed
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 WO claimed
US-20080187575-A1 Pyrimidine Derivatives VICHEM CHEMIE KFT (HU) 2008-08-07 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-20080187575-A1 Pyrimidine Derivatives TYMP, TDP1, PNP IKBKB 875/4885CHUK 597/4885ABL1 2843/4885

“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.