SCHEMBL4098240

SCHEMBL4098240

C[Sn](C)(C)C#CC1=CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.42
GRM5 P41594 2/20 0.42
FFAR1 O14842 1/20 0.37
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.34
CTSK P43235 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL4222484 0.76
SCHEMBL11744141 0.71
SCHEMBL4854449 0.71
SCHEMBL5774580 0.71
SCHEMBL11746719 0.71
SCHEMBL3353849 0.71 CYP1A2 (0.50) CYP1A2GRM5FFAR1NPC1RAB9A
SCHEMBL11741921 0.70 CYP1A2 (0.44) CYP1A2GRM5FFAR1NPC1RAB9A
SCHEMBL11746901 0.70 CYP1A2 (0.44) CYP1A2GRM5FFAR1NPC1RAB9A
SCHEMBL25236714 0.68 CYP1A2 (0.40) CYP1A2GRM5FFAR1NPC1RAB9A
SCHEMBL551705 0.67 CYP1A2 (0.36) CYP1A2GRM5FFAR1NPC1RAB9A

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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2009-03-12 US disclosed
EP-1844051-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-17 EP disclosed
WO-2006077412-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION NPY5R, TH, PTGES CYP1A2 375/4885GRM5 209/4885FFAR1 3026/4885

“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.