SCHEMBL5463136

SCHEMBL5463136

O=Cc1cc(Br)ccc1OCC1CCCC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.55
PTGER1 P34995 2/20 0.42
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
SRC P12931 1/20 0.40
PTGDR Q13258 1/20 0.40
ERN1 O75460 1/20 0.40
HPGD P15428 5/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 2/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SLC6A4 P31645 1/20 0.39
HTR6 P50406 1/20 0.39

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
SCHEMBL30679664 0.99 PTGDR2 (0.54) PTGDR2PTGER1PLA2G1BATG4BSRC
SCHEMBL29964746 0.94 PTGDR2 (0.57) PTGDR2PTGER1PLA2G1BATG4BPTGDR
SCHEMBL17061451 0.94 PTGDR2 (0.57) PTGDR2PTGER1PLA2G1BATG4BPTGDR
SCHEMBL4052501 0.87 PTGDR2 (0.51) PTGDR2PLA2G1BATG4BTDP1SLC6A4
SCHEMBL29964495 0.87 PTGDR2 (0.51) PTGDR2PLA2G1BATG4BERN1HPGD
SCHEMBL27159746 0.87 PTGDR2 (0.51) PTGDR2PLA2G1BATG4BERN1HPGD
SCHEMBL20912029 0.87 SRC (0.45) PTGDR2PTGER1SRCPTGDRHPGD
Hydrochloric Acid SCHEMBL15537884 0.86 PTGDR2 (0.50) PTGDR2PLA2G1BATG4BTDP1SLC6A4
SCHEMBL12462495 0.82 PARP10 (0.51) SRCHPGD
SCHEMBL5472935 0.82 SLC6A4 (0.53) PTGDR2PTGER1PTGDRHPGDSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070072906-A1 Pyrrole compounds GLAXO GROUP LIMITED (GB) 2007-03-29 US disclosed
US-20070072906-A1 Pyrrole compounds GLAXO GROUP LIMITED (GB) 2007-03-29 US disclosed
US-20070072906-A1 Pyrrole compounds GLAXO GROUP LIMITED (GB) 2007-03-29 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-20070072906-A1 Pyrrole compounds PRMT9, EPOR, ADCYAP1R1 PTGDR2 133/4885PTGER1 224/4885PLA2G1B 1671/4885

“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.