SCHEMBL4522396

SCHEMBL4522396

CC(C)(C)OC(=O)Nc1cccc(Nc2nc(Cl)nc(Cl)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.56
NFKB1 P19838 2/20 0.52
BRD4 O60885 1/20 0.49
MET P08581 1/20 0.45
CYP17A1 P05093 1/20 0.45
POLB P06746 2/20 0.45
NAMPT P43490 1/20 0.44
CDK1 P06493 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
NPR3 P17342 1/20 0.43
EGFR P00533 1/20 0.43
SRC P12931 1/20 0.43
PTK2 Q05397 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
APP P05067 2/20 0.43

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
SCHEMBL13921823 0.93 SYK (0.55) SYKNFKB1BRD4METCYP17A1
SCHEMBL23345470 0.87 POLB (0.60) SYKNFKB1CYP17A1POLBNAMPT
SCHEMBL13921831 0.86 RAB9A (0.51) SYKBRD4RAB9A
SCHEMBL13921824 0.86 SYK (0.60) SYKBRD4METCYP17A1NAMPT
SCHEMBL27714837 0.83 NPC1 (0.58) NFKB1POLBNAMPTNPC1RAB9A
SCHEMBL4518592 0.82 FCGR3B (0.53) SYKBRD4METNPR3EGFR
SCHEMBL29029431 0.82 HDAC3 (0.56) SYKBRD4CYP17A1NAMPTHDAC3
SCHEMBL3246720 0.81 POLB (0.68) NFKB1POLBRAB9ASRCHSD17B10
SCHEMBL29537493 0.81 BRD4 (0.53) SYKBRD4METCYP17A1NAMPT
SCHEMBL28850302 0.81 SYK (0.50) SYKBRD4CYP17A1NAMPTCDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090068169-A1 2,4,6-triamino-s-triazine-based compounds which bind to the tail (fc) portion of immunoglobulins and their use PROMETIC BIOSCIENCES INC. (CA) 2009-03-12 US disclosed
US-20090068169-A1 2,4,6-triamino-s-triazine-based compounds which bind to the tail (fc) portion of immunoglobulins and their use PROMETIC BIOSCIENCES INC. (CA) 2009-03-12 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-20090068169-A1 2,4,6-triamino-s-triazine-based compounds which bind to the tail (fc) portion of immunoglobulins and their use FCGR2A, FCGR3B, FCGR1A SYK 71/4885NFKB1 2115/4885BRD4 50/4885

“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.