SCHEMBL4159784

SCHEMBL4159784

CCOC(=O)c1cccc(C2=C(c3cc(Br)cnc3OC)CCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 9/20 0.48
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.43
GALR1 P47211 1/20 0.41
BRAF P15056 1/20 0.40

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
SCHEMBL5619481 0.83 PTGER1 (0.59) PTGER1NPC1GALR1
SCHEMBL4159104 0.83 GRM7 (0.40) PTGER1SMN1; SMN2NPC1
SCHEMBL6141435 0.81 PTGER1 (0.52) PTGER1NPC1GALR1
SCHEMBL4151518 0.79 PTGER1 (0.61) PTGER1SMN1; SMN2NPC1
SCHEMBL5620571 0.78 PTGER1 (0.57) PTGER1NPC1GALR1BRAF
SCHEMBL4162371 0.77 GALR1 (0.52) SMN1; SMN2NPC1GALR1
SCHEMBL4162478 0.77 PTGER1 (0.63) PTGER1
SCHEMBL27796213 0.76 NPC1 (0.46) SMN1; SMN2NPC1GALR1BRAF
SCHEMBL5619860 0.73 PTGER1 (0.47) PTGER1SMN1; SMN2BRAF
SCHEMBL5620526 0.73 PTGER1 (0.60) PTGER1NPC1GALR1

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-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 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-20090227591-A1 Cyclopentene compounds C1R, CYP1B1, ADORA2B PTGER1 246/4885SMN1; SMN2 3323/4885NPC1 474/4885

“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.