SCHEMBL2175223

SCHEMBL2175223

CCCCCOc1ccn(Cc2ccc(OC)c(OCCN(C)C)c2Cl)c(=O)c1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRA P10827 6/20 0.41
THRB P10828 6/20 0.41
TLR7 Q9NYK1 2/20 0.41
CNR2 P34972 2/20 0.37
MCHR1 Q99705 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL2176011 0.90 CNR2 (0.39) CNR2ALDH1A1KDM4E
SCHEMBL2175566 0.89 CNR2 (0.39) CNR2ALDH1A1KDM4E
SCHEMBL2175196 0.85 LTA4H (0.45) MCHR1ALDH1A1KDM4E
SCHEMBL2179803 0.84 MAPK14 (0.53) MCHR1ALDH1A1
SCHEMBL2174906 0.83 CNR2 (0.41) CNR2
SCHEMBL2174968 0.82 CNR2 (0.39) TLR7CNR2
SCHEMBL2178553 0.80 MEN1 (0.40) CNR2ALDH1A1
SCHEMBL2177989 0.77 MEN1 (0.41) ALDH1A1KDM4E
SCHEMBL2178809 0.77 THRA (0.37) THRATHRBTLR7MCHR1
SCHEMBL2177809 0.77 MCHR1 (0.41) THRATHRBTLR7MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948601-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME Crystalgenomics, Inc. (KR) 2008-07-30 EP claimed
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 US claimed
WO-2007043835-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME CRYSTALGENOMICS, INC. (KR) 2007-04-19 WO claimed
US-7973060-B2 Fab I inhibitor and process for preparing same CRYSTALGENOMICS, INC. (KR) 2011-07-05 US disclosed
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 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-20070135465-A1 Fab I Inhibitor and Process for Preparing Same TFPI, TFPI2, FCGRT THRA 4283/4885THRB 4479/4885TLR7 3515/4885

“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.