SCHEMBL6564631

SCHEMBL6564631

CCCCNC(=O)c1cc(NC(=O)Nc2ccccc2)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.47
HTT P42858 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MCHR1 Q99705 6/20 0.47
TSHR P16473 1/20 0.46
C5 P01031 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
BACE1 P56817 1/20 0.43
BACE2 Q9Y5Z0 1/20 0.43
MCHR2 Q969V1 2/20 0.42
ESRRA P11474 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL6565942 0.90 MCHR1 (0.54) MCHR1
SCHEMBL6566738 0.89 MCHR1 (0.45) MCHR1BACE1BACE2MCHR2ESRRA
SCHEMBL6566645 0.89 KDM4E (0.53) EPHX1HTTALDH1A1MCHR1TSHR
SCHEMBL6565928 0.88 MCHR1 (0.46) MCHR1MCHR2ESRRAHPGD
SCHEMBL6566565 0.88 PAX8 (0.55) HTTALDH1A1MCHR1BACE1BACE2
SCHEMBL6567876 0.87 RAF1 (0.44) HTTMCHR1ESRRA
SCHEMBL6567969 0.87 CASR (0.53) MCHR1
SCHEMBL6564619 0.87 MCHR1 (0.49) MCHR1BACE1BACE2MCHR2
SCHEMBL6567939 0.87 MCHR1 (0.53) ALDH1A1MCHR1
SCHEMBL6566514 0.86 MCHR1 (0.52) MCHR1BACE1BACE2

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 EPHX1 2037/4885HTT 2150/4885ALDH1A1 907/4885

“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.