Anthracene

Anthracene

SCHEMBL5574730

OB(Oc1ccccc1)c1ccccc1.c1ccc2cc3ccccc3cc2c1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
ORAI1 Q96D31 3/20 0.41
ORAI2 Q96SN7 3/20 0.41
ORAI3 Q9BRQ5 3/20 0.41
TRPV6 Q9H1D0 3/20 0.41
ENPP2 Q13822 2/20 0.41
CA4 P22748 2/20 0.41
CA5A P35218 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
CA6 P23280 1/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
PCSK9 Q8NBP7 1/20 0.41
CYP26B1 Q9NR63 1/20 0.38
MGLL Q99685 1/20 0.36
LTA4H P09960 1/20 0.33
TSHR P16473 1/20 0.33
CYP1A2 P05177 2/20 0.32
KDM4E B2RXH2 2/20 0.32

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
SCHEMBL2475622 0.91 ORAI1 (0.48) CA1CA2ORAI1ORAI2ORAI3
SCHEMBL28424021 0.84 CA1 (0.48) CA1CA2ORAI1ORAI2ORAI3
Benzofuran SCHEMBL29036402 0.79 CA2 (0.35) CA1CA2ORAI1ORAI2ORAI3
Monoethanolamine SCHEMBL9783347 0.79 ALDH1A1 (0.40) CA1CA2ORAI1ORAI2ORAI3
SCHEMBL29361893 0.79 ALDH1A1 (0.41) CA1CA2CYP1A2KDM4EMEN1
SCHEMBL5134895 0.79 ALDH1A1 (0.41) CA1CA2CYP1A2KDM4EMEN1
SCHEMBL6379719 0.79 ENPP2 (0.48) CA1CA2ORAI1ORAI2ORAI3
SCHEMBL5317235 0.78 ORAI1 (0.41) CA1CA2ORAI1ORAI2ORAI3
SCHEMBL12538977 0.78 CA1 (0.39) CA1CA2ORAI1ORAI2ORAI3
SCHEMBL29133596 0.78 CA2 (0.46) CA1CA2ORAI1ORAI2ORAI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007070827-A2 CONTRAST AGENTS FOR MYOCARDIUM PERFUSION IMAGING BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-06-21 WO disclosed
US-20070140973-A1 CONTRAST AGENTS FOR MYOCARDIUM PERFUSION IMAGING BRISTOL-MYERS SQUIBB PHARMA COMPANY 2007-06-21 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-20070140973-A1 CONTRAST AGENTS FOR MYOCARDIUM PERFUSION IMAGING TNNI3, TNNT2, TNNC1 CA1 1664/4885CA2 517/4885ORAI1 2921/4885

“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.