SCHEMBL6314083

SCHEMBL6314083

Nc1ncc(-c2ccc(Br)cc2F)c(Nc2cnc3ccccc3c2)n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALPL P05186 4/20 0.41
PIK3CA P42336 4/20 0.41
TNF P01375 1/20 0.41
PPARG P37231 1/20 0.39
GRM4 Q14833 1/20 0.39
EGFR P00533 1/20 0.39
ALOX12 P18054 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
KDR P35968 2/20 0.37
ULK1 O75385 1/20 0.36

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
SCHEMBL6317775 0.86 BCL6 (0.42) BCL6MEN1KMT2AALPLPIK3CA
SCHEMBL6318945 0.84 TNF (0.44) BCL6MEN1KMT2AALPLPIK3CA
SCHEMBL6315288 0.76 PDGFRB (0.49) BCL6PIK3CATNFGRM4NPSR1
SCHEMBL6318862 0.76 DHFR (0.56) BCL6PIK3CATNFGRM4NPSR1
SCHEMBL6315310 0.75 ADORA1 (0.45) BCL6MEN1KMT2AALPLPIK3CA
SCHEMBL6318985 0.74 PIK3CA (0.46) BCL6MEN1KMT2AALPLPIK3CA
SCHEMBL6311387 0.73 IGF1R (0.47) ALPLPIK3CATNFEGFRKDR
SCHEMBL6313731 0.72 PIK3CA (0.41) BCL6KMT2AALPLPIK3CATNF
SCHEMBL6313634 0.72 ALPL (0.49) ALPLPIK3CATNF
SCHEMBL6312550 0.72 CA12 (0.56) KMT2AALPLPIK3CATNFGRM4

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-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US claimed
EP-1427421-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS Amgen Inc. (US) 2004-06-16 EP claimed
US-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. 2004-04-01 US claimed
WO-2003018021-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS AMGEN INC. (US) 2003-03-06 WO claimed
US-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US disclosed
US-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. 2004-04-01 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-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use DPYD, TYMP, TPMT BCL6 995/4885MEN1 1164/4885KMT2A 2974/4885

“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.