SCHEMBL2804683

SCHEMBL2804683

O=C(O)c1ccc(Br)c(OCC2CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.48
NR1H4 Q96RI1 3/20 0.48
MAP4K4 O95819 1/20 0.47
PARP15 Q460N3 1/20 0.45
PARP10 Q53GL7 1/20 0.45
PARP2 Q9UGN5 1/20 0.45
PDE4B Q07343 7/20 0.44
PDE4A P27815 4/20 0.44
PDE4C Q08493 4/20 0.44
PDE4D Q08499 4/20 0.44
PTGER1 P34995 2/20 0.43
PIM1 P11309 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
XDH P47989 1/20 0.42
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL15968144 0.88 DPP4 (0.48) DPP4NR1H4MAP4K4PARP15PARP10
SCHEMBL15541722 0.87 PDE4B (0.46) PARP15PARP10PARP2PDE4BPDE4A
SCHEMBL28034346 0.86 PDE4B (0.53) NR1H4MAP4K4PARP15PARP10PARP2
SCHEMBL2802032 0.84 PDE4B (0.47) PARP15PARP10PARP2PDE4BPDE4A
SCHEMBL20053762 0.83 NR1H4 (0.52) NR1H4MAP4K4PARP15PARP10PARP2
SCHEMBL6051023 0.83 HTT (0.54) NR1H4MAP4K4PARP15PARP10PARP2
SCHEMBL16335578 0.83 PDE4B (0.43) PARP15PARP10PARP2PDE4BPDE4A
SCHEMBL16336082 0.83 PDE4B (0.43) PARP15PARP10PARP2PDE4BPDE4A
SCHEMBL4510982 0.82 PTGER4 (0.48) PDE4BPDE4APDE4CPDE4D
SCHEMBL662159 0.82 TTR (0.50) NR1H4MAP4K4PARP15PARP10PARP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 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-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy PTGER1, SULT2A1, SULT1E1 DPP4 1458/4885NR1H4 145/4885MAP4K4 2125/4885

“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.