SCHEMBL5155559

SCHEMBL5155559

COc1ccc(Br)cc1-c1ccccc1I

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.48
RAB9A P51151 2/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.47
MGAM O43451 1/20 0.44
GAA P10253 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HTR7 P34969 2/20 0.41
RXFP1 Q9HBX9 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
PPARG P37231 1/20 0.40
GFER P55789 1/20 0.40
NCOA2 Q15596 1/20 0.40
NCOA1 Q15788 1/20 0.40
SMN1; SMN2 Q16637 2/20 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
SCHEMBL14125145 0.83 GAA (0.56) NPC1RAB9ATSHRHTTMGAM
SCHEMBL6267736 0.79 NPC1 (0.48) NPC1RAB9ATSHRHTTMGAM
SCHEMBL26401723 0.79 PTPRC (0.47) NPC1GAAALDH1A1MEN1MAPK1
SCHEMBL1367446 0.79 CA1 (0.52) TSHRGAALMNAHTR7ALDH1A1
SCHEMBL5157748 0.77 NPC1 (0.46) NPC1RAB9ATSHRHTTMGAM
SCHEMBL20321771 0.77 NPC1 (0.54) NPC1RAB9ATSHRHTTMGAM
SCHEMBL5157744 0.77 ENPP2 (0.50) NPC1RAB9ATSHRHTTMGAM
SCHEMBL5827764 0.77 NPC1 (0.63) NPC1RAB9ATSHRHTTMGAM
SCHEMBL4436860 0.76 NPC1 (0.42) NPC1RAB9ATSHRHTTMGAM
SCHEMBL20321554 0.76 AMY1A (0.45) NPC1RAB9ATSHRHTTMGAM

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-20070225340-A1 Phenyl Compounds And Their Use In The Treatment Of Conditions Mediated By The Action Of Pge2 At The Ep1 Receptor GLAXO GROUP LIMITED (GB) 2007-09-27 US disclosed
EP-1742916-A1 PHENYL COMPOUNDS AND THEIR USE IN THE TREATMENT OF CONDITIONS MEDIATED BY THE ACTION OF PGE2 AT THE EP1 RECEPTOR GLAXO GROUP LIMITED (GB) 2007-01-17 EP disclosed
WO-2005108369-A1 PHENYL COMPOUNDS AND THEIR USE IN THE TREATMENT OF CONDITIONS MEDIATED BY THE ACTION OF PGE2 AT THE EP1 RECEPTOR GLAXO GROUP LIMITED (GB) 2005-11-17 WO 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-20070225340-A1 Phenyl Compounds And Their Use In The Treatment Of Conditions Mediated By The Action Of Pge2 At The Ep1 Receptor PTGER1, PTGER2, PTGDR NPC1 810/4885RAB9A 1313/4885TSHR 362/4885

“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.