SCHEMBL3544366

SCHEMBL3544366

CCCc1c[c]cc(OC)c1OC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.43
DHFR P00374 1/20 0.37
CYP1A2 P05177 1/20 0.36
PTGS2 P35354 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.33
CYP3A4 P08684 1/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
ALOX5 P09917 4/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 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
SCHEMBL3549529 0.89 ALOX5 (0.39) CYP1A2PTGS2HTR2AALOX5
SCHEMBL3551837 0.88 HMGCR (0.39) HMGCRDHFRPTGS2ALDH1A1KDM4E
SCHEMBL3550525 0.87 ALOX5 (0.45) PTGS2HTR2AALOX5
SCHEMBL3546691 0.86 ALOX5 (0.46) PTGS2HTR2AALOX5
SCHEMBL2289387 0.84 PTGS2 (0.42) CYP1A2PTGS2ALDH1A1KDM4ECYP3A4
SCHEMBL3546782 0.83 HMGCR (0.33) HMGCRDHFR
SCHEMBL3544169 0.82 ALOX5 (0.32) CYP1A2PTGS2HTR2AALOX5
SCHEMBL3540257 0.80 CYP1A2 (0.37) CYP1A2HTR2AHTR2CHTR2B
SCHEMBL3546384 0.80 CYP1A2 (0.33) CYP1A2SMN1; SMN2HTR2AHTR2CHTR2B
SCHEMBL3544500 0.80 TNKS2 (0.40) CYP1A2PTGS2ALDH1A1CYP3A4ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691843-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2010-04-06 US claimed
US-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity VICURON HOLDINGS LLC 2008-03-06 US claimed
US-7691843-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2010-04-06 US disclosed
US-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity VICURON HOLDINGS LLC 2008-03-06 US disclosed
EP-1539744-A4 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARM INC (US) 2007-06-06 EP disclosed
EP-1539744-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2005-06-15 EP disclosed
WO-2004007444-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2004-01-22 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-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity AMDHD2, OGA, ENGASE HMGCR 2117/4885DHFR 3454/4885CYP1A2 3740/4885

“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.