SCHEMBL6566982

SCHEMBL6566982

COC(=O)c1cc(NC(=O)N(C)Cc2ccccc2)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MTOR P42345 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
CASR P41180 2/20 0.46
ABCC1 P33527 1/20 0.45
TP53 P04637 1/20 0.43
BCHE P06276 3/20 0.41
ACHE P22303 3/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
NPY5R Q15761 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
RORC P51449 1/20 0.40
MTTP P55157 1/20 0.40

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
SCHEMBL6566999 0.88 CASR (0.41) CASRNPY5RMEN1LMNAKMT2A
SCHEMBL6568097 0.87 CASR (0.54) CASRKDM4EALDH1A1LMNA
SCHEMBL6565794 0.86 KMT2A (0.44) CASRKDM4EALDH1A1MEN1LMNA
SCHEMBL6568024 0.84 KDM4E (0.48) BCHEACHEKDM4EALDH1A1NPY5R
SCHEMBL6568022 0.82 CASR (0.45) CA12CA1CA2CA9CASR
SCHEMBL6566741 0.82 MEN1 (0.52) CA12CA1CA2CA9CASR
SCHEMBL6566546 0.82 PDE4A (0.48) CASRTP53KDM4EALDH1A1NPY5R
SCHEMBL6567020 0.82 KDM4E (0.51) CASRKDM4EALDH1A1MEN1KMT2A
SCHEMBL6564496 0.81 CASR (0.50) CASRTP53KDM4EALDH1A1LMNA
SCHEMBL6566976 0.81 NAMPT (0.44) ALDH1A1MEN1LMNAKMT2A

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 MTOR 4361/4885CA12 4703/4885CA1 3612/4885

“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.