SCHEMBL5599314

SCHEMBL5599314

CCCCCCCCCCc1cccc(I)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 3/20 0.57
LIPG Q9Y5X9 3/20 0.57
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
KCNH2 Q12809 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
SHBG P04278 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46

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
SCHEMBL23347584 1.00 LPL (0.57) LPLLIPGPPARGPPARAKCNH2
SCHEMBL2114808 0.98 LPL (0.56) LPLLIPGPPARGPPARATDP1
SCHEMBL30138668 0.92 LPL (0.49) LPLLIPGHIF1A
SCHEMBL4194332 0.92 LPL (0.49) LPLLIPGHIF1A
SCHEMBL8661179 0.87 LPL (0.50) LPLLIPGPPARGPPARA
SCHEMBL4032533 0.86 LPL (0.67) LPLLIPGPPARGPPARAKCNH2
SCHEMBL10518886 0.86 LPL (0.67) LPLLIPGPPARGPPARAKCNH2
SCHEMBL29742685 0.86 LPL (0.67) LPLLIPGPPARGPPARAKCNH2
SCHEMBL6932623 0.86 LPL (0.67) LPLLIPGPPARGPPARAKCNH2
SCHEMBL5249436 0.86 LPL (0.67) LPLLIPGPPARGPPARAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1312605-B1 Method for producing biaryl compounds SUMITOMO CHEMICAL CO (JP) 2007-04-25 EP disclosed
US-7122711-B2 Method for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-17 US disclosed
US-20030158419-A1 Method for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2003-08-21 US disclosed
EP-1312605-A1 Method for producing biaryl compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-05-21 EP 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-20030158419-A1 Method for producing biaryl compound B2M, BMI1, CYP2W1 LPL 3464/4885LIPG 2599/4885PPARG 1276/4885

“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.