SCHEMBL6566700

SCHEMBL6566700

CC(=O)c1cc(N)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
IRAK4 Q9NWZ3 2/20 0.40
LTB4R Q15722 2/20 0.38
LTB4R2 Q9NPC1 2/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.38
SRD5A2 P31213 1/20 0.37
ALOX5 P09917 1/20 0.37
MEN1 O00255 2/20 0.37
THRB P10828 2/20 0.37
RECQL P46063 2/20 0.37
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAPT P10636 2/20 0.37
CYP3A4 P08684 2/20 0.37
KDR P35968 2/20 0.37
USP2 O75604 1/20 0.37
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
APEX1 P27695 1/20 0.37
BLM P54132 1/20 0.37

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
SCHEMBL6565676 0.86 IRAK4 (0.39) ALDH1A1IRAK4ALOX5MEN1KMT2A
SCHEMBL6564614 0.86 ALOX5 (0.38) ALDH1A1IRAK4LTB4RLTB4R2PTGDR2
SCHEMBL6564533 0.86 GAA (0.48) ALDH1A1ALOX5MEN1KMT2AMAPT
SCHEMBL6564681 0.85 PPARA (0.41) ALDH1A1LTB4RLTB4R2PTGDR2SRD5A2
SCHEMBL6564823 0.82 LTB4R (0.38) ALDH1A1LTB4RLTB4R2PTGDR2MEN1
SCHEMBL6567908 0.82 GRM6 (0.36) ALDH1A1IRAK4LTB4RLTB4R2PTGDR2
SCHEMBL6566983 0.81 MAPT (0.39) ALDH1A1ALOX5MEN1KMT2AMAPT
SCHEMBL7904029 0.81 IRAK4 (0.50) ALDH1A1IRAK4ALOX5MEN1THRB
SCHEMBL6714085 0.81 ALDH1A1 (0.40) ALDH1A1LTB4RLTB4R2PTGDR2SRD5A2
SCHEMBL6709212 0.81 IDO1 (0.45) ALDH1A1SRD5A2MEN1THRBRECQL

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
US-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US disclosed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof HRH4, HRH2, HRH1 ALDH1A1 907/4885IRAK4 2217/4885LTB4R 445/4885

“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.