SCHEMBL19243142

SCHEMBL19243142

CC(CCCc1ccc(-c2cccs2)cc1)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.51
SIGMAR1 Q99720 1/20 0.46
LTA4H P09960 1/20 0.45
EPHX2 P34913 1/20 0.45
BCHE P06276 4/20 0.45
PSMB5 P28074 2/20 0.44
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
MMP12 P39900 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
SCHEMBL1723830 0.81 FFAR1 (0.59) FFAR1LTA4HBCHEPPARGPPARA
SCHEMBL8157173 0.74 MMP12 (0.61) FFAR1SIGMAR1LTA4HEPHX2BCHE
SCHEMBL28176410 0.72 LTA4H (0.65) FFAR1SIGMAR1LTA4HEPHX2BCHE
SCHEMBL25108838 0.71 BCHE (0.57) BCHE
SCHEMBL10875504 0.70 ALOX5 (0.57) LTA4HBCHE
SCHEMBL10877817 0.70 ALOX5 (0.57) LTA4HBCHE
SCHEMBL27677483 0.70 LTA4H (0.62) FFAR1SIGMAR1LTA4HEPHX2BCHE
SCHEMBL8149319 0.70 ALOX5 (0.57) FFAR1LTA4HEPHX2BCHE
SCHEMBL23641504 0.70 CYP17A1 (0.51) FFAR1LTA4HPPARGPPARA
SCHEMBL14118337 0.69 BCHE (0.55) FFAR1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170233414-A1 DERIVATIVES OF BODIPY OREGON HEALTH & SCIENCE UNIVERSITY (US) 2017-08-17 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-20170233414-A1 DERIVATIVES OF BODIPY NPC1L1, NPC1, ABCB4 FFAR1 281/4885SIGMAR1 2791/4885LTA4H 2000/4885

“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.