SCHEMBL6567888

SCHEMBL6567888

COc1ccc(CCNC(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC(c2ccccc2)c2ccccc2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.54
MAPT P10636 3/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
POLB P06746 3/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
THRB P10828 1/20 0.49
ALDH1A1 P00352 2/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.48
LMNA P02545 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 1/20 0.48
ALOX12 P18054 1/20 0.48

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
SCHEMBL6568066 0.89 EPHX1 (0.49) CNR1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL6564606 0.88 CNR1 (0.58) CNR1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL6565928 0.85 MCHR1 (0.46) MEN1KMT2ASMN1; SMN2LMNAHPGD
SCHEMBL6566515 0.85 NAMPT (0.52) MAPTMEN1KMT2ASMN1; SMN2POLB
SCHEMBL6565988 0.84 KDM4E (0.48) CNR1MEN1KMT2APOLBALDH1A1
SCHEMBL6566645 0.84 KDM4E (0.53) CNR1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL6566630 0.83 PRMT3 (0.46) MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL6564631 0.82 EPHX1 (0.47) ALDH1A1L3MBTL1HPGD
SCHEMBL6567969 0.82 CASR (0.53) MEN1KMT2A
SCHEMBL6567876 0.82 RAF1 (0.44) MAPTMEN1KMT2ASMN1; SMN2CYP3A4

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 CNR1 22/4885MAPT 4743/4885MEN1 4143/4885

“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.