SCHEMBL5995511

SCHEMBL5995511

COc1ccc(Br)c(C(=O)Nc2cnc(Nc3ccc(C(=O)NCCN4CCCC4)cc3)nc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.55
▸ KIT P10721 1/20 0.51
▸ BRAF P15056 2/20 0.49
▸ GLA P06280 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ JAK2 O60674 1/20 0.46
▸ BRD4 O60885 1/20 0.46
▸ RET P07949 1/20 0.46
▸ JAK1 P23458 1/20 0.46
▸ TYK2 P29597 1/20 0.46
▸ FLT3 P36888 1/20 0.46
▸ JAK3 P52333 1/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ LCK P06239 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ MAPK14 Q16539 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.45
▸ DRD2 P14416 1/20 0.44

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
SCHEMBL5998211 0.90 KIT (0.52) POLBKITBRAFGLAL3MBTL1
SCHEMBL13605508 0.81 POLB (0.67) POLBBRAFGLAL3MBTL1JAK2
SCHEMBL5995525 0.81 LCK (0.43) POLBHDAC1HDAC6LCKKDR
SCHEMBL13605542 0.81 POLB (0.66) POLBBRAFGLAL3MBTL1JAK2
SCHEMBL5996051 0.79 ABL1 (0.55) KITBRAFLCKKDRMAPK14
SCHEMBL5997421 0.78 SRC (0.57) POLBKITBRAFGLAL3MBTL1
SCHEMBL5999296 0.78 KIT (0.54) POLBKITBRAFGLAL3MBTL1
SCHEMBL5994762 0.78 ABL1 (0.53) KITBRAFNPSR1IKBKBCHUK
SCHEMBL5997320 0.76 SRC (0.48) KDRSRCKMT2A
SCHEMBL5996926 0.76 LCK (0.61) KITBRAFGLAL3MBTL1JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060247250-A1 Pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2006-11-02 — — 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-20060247250-A1 Pyrimidine inhibitors of kinases DTYMK, SRC, DCK POLB 1133/4885KIT 209/4885BRAF 125/4885

“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.

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