SCHEMBL6567065

SCHEMBL6567065

CCN(CCOC)C(=O)Nc1ccc(OC(c2ccccc2)c2ccccc2)c(C(=O)OC)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CASR P41180 7/20 0.43
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MCHR1 Q99705 2/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
KCNH2 Q12809 1/20 0.40
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
NAMPT P43490 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6564738 0.96 CASR (0.44) CASRHDAC1HDAC6NAMPTMEN1
SCHEMBL6568022 0.89 CASR (0.45) CASRMEN1KMT2ALMNAMAPT
SCHEMBL6566485 0.84 NAMPT (0.44) MCHR1LTB4RLTB4R2NAMPTMEN1
SCHEMBL6566546 0.84 PDE4A (0.48) CASRMEN1KMT2ALMNAMAPT
SCHEMBL6566999 0.84 CASR (0.41) CASRMEN1KMT2ALMNAMAPT
SCHEMBL6568097 0.83 CASR (0.54) CASRHDAC1HDAC6LMNASMN1; SMN2
SCHEMBL6567930 0.83 MEN1 (0.43) HDAC1HDAC6MCHR1NAMPTMEN1
SCHEMBL6566675 0.81 CASR (0.57) CASRMEN1KMT2ALMNAMAPT
SCHEMBL6564496 0.80 CASR (0.50) CASRHDAC1HDAC6LMNATP53
SCHEMBL6566703 0.80 MEN1 (0.50) CASRKCNH2MEN1KMT2ALMNA

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 CASR 1621/4885HDAC1 1346/4885HDAC6 1541/4885

“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.