SCHEMBL6568233

SCHEMBL6568233

COc1ccc(NC(=O)Nc2ccc(OC(c3ccc(C(F)(F)F)cc3)c3cccc(Cl)c3)c(C(=O)NC(C)(C)C)c2)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
IMPDH2 P12268 1/20 0.40
IMPDH1 P20839 1/20 0.40
MCHR1 Q99705 2/20 0.40
ANO1 Q5XXA6 1/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
LRRK2 Q5S007 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
PPARA Q07869 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ATM Q13315 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
SCHEMBL6566572 0.92 POLB (0.43) POLBIMPDH2IMPDH1MAPTKDM4E
SCHEMBL6564637 0.92 IMPDH2 (0.44) IMPDH2IMPDH1MCHR1ANO1MAPT
SCHEMBL6567816 0.91 MTOR (0.45) IMPDH2IMPDH1MCHR1ANO1MAPT
SCHEMBL6567699 0.90 MAPT (0.48) POLBMCHR1MAPTKDM4ESMN1; SMN2
SCHEMBL6568055 0.90 MAPT (0.47) POLBMCHR1MAPTKDM4ESMN1; SMN2
SCHEMBL6567587 0.88 IMPDH2 (0.44) POLBIMPDH2IMPDH1MCHR1ANO1
SCHEMBL6565012 0.87 IMPDH2 (0.40) IMPDH2IMPDH1MCHR1ANO1MAPT
SCHEMBL6566869 0.87 RAB9A (0.43) POLBIMPDH2IMPDH1ANO1MAPT
SCHEMBL6566690 0.85 KMT2A (0.42) IMPDH2IMPDH1MCHR1ANO1MAPT
SCHEMBL6567917 0.84 IMPDH2 (0.51) POLBIMPDH2IMPDH1MAPTKDM4E

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 POLB 3499/4885IMPDH2 4497/4885IMPDH1 4113/4885

“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.