SCHEMBL4903370

SCHEMBL4903370

CN1CCN(CC(=O)Nc2cccc(Nc3nccc(-c4ccccn4)n3)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 16/20 0.59
JAK2 O60674 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
ABL1 P00519 1/20 0.55
PDGFRB P09619 1/20 0.55
BCR P11274 1/20 0.55
SRC P12931 1/20 0.55
PDGFRA P16234 1/20 0.55
ADORA2A P29274 2/20 0.54
ADORA1 P30542 2/20 0.54
MET P08581 1/20 0.53
ALK Q9UM73 1/20 0.53

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
SCHEMBL4896995 0.91 JAK2 (0.60) SYKJAK2HDAC1HDAC6ADORA2A
SCHEMBL4903833 0.89 SYK (0.57) SYKJAK2ABL1BCRMET
SCHEMBL4900241 0.88 SYK (0.53) SYKJAK2HDAC1HDAC6
SCHEMBL4892505 0.87 ABL1 (0.57) SYKABL1PDGFRBBCRSRC
SCHEMBL4891563 0.87 JAK2 (0.64) SYKJAK2HDAC1HDAC6ABL1
SCHEMBL4901650 0.86 DRD2 (0.52) SYKABL1PDGFRBBCRSRC
SCHEMBL4894465 0.86 ABL1 (0.73) SYKJAK2HDAC1HDAC6ABL1
SCHEMBL4900828 0.84 ABL1 (0.78) SYKABL1PDGFRBBCRSRC
SCHEMBL4900317 0.84 DRD2 (0.51) SYKJAK2HDAC1HDAC6
SCHEMBL4900774 0.82 ABL1 (0.59) SYKJAK2HDAC1HDAC6ABL1

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 6 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
EP-1786781-A2 PYRIMIDINE DERIVATIVES GPC Biotech AG (DE) 2007-05-23 EP disclosed
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 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-20080187575-A1 Pyrimidine Derivatives TYMP, TDP1, PNP SYK 2145/4885JAK2 1695/4885HDAC1 4522/4885

“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.