SCHEMBL3907147

SCHEMBL3907147

CCOC(=O)c1c(-c2ccccc2)oc(C)c1-c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.51
KDM4E B2RXH2 8/20 0.51
HPGD P15428 7/20 0.51
GAA P10253 4/20 0.51
LMNA P02545 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
MAPT P10636 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
TP53 P04637 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.49
APAF1 O14727 1/20 0.49
MITF O75030 1/20 0.49
PTGS2 P35354 3/20 0.48
PRNP P04156 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
GRM6 O15303 1/20 0.46

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
SCHEMBL5748965 0.86 MEN1 (0.47) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL5752932 0.85 MEN1 (0.49) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL5754159 0.84 MEN1 (0.48) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL22730883 0.80 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL3907291 0.79 GRM6 (0.46) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL280167 0.76 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL2402345 0.75 MEN1 (0.60) ALDH1A1KDM4EHPGDGAASMN1; SMN2
SCHEMBL18781917 0.75 MAPT (0.65) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL29858565 0.75 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL28265156 0.75 MAPT (0.51) ALDH1A1KDM4EHPGDGAALMNA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7553867-B2 Furan or thiophene derivative and medicinal use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-30 US disclosed
US-7553867-B2 Furan or thiophene derivative and medicinal use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-30 US disclosed
US-7553867-B2 Furan or thiophene derivative and medicinal use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-30 US disclosed
US-20060100261-A1 Furan or thiopene derivative and medicinal use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED INTELLECTUAL PROPERTY DEPARTMENT (JP) 2006-05-11 US disclosed
US-6982348-B2 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-03 US disclosed
EP-1535915-A1 FURAN OR THIOPHENE DERIVATIVE AND MEDICINAL USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-06-01 EP disclosed
US-20040127574-A1 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-07-01 US disclosed
EP-1362846-A1 AMINOETHANOL DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-11-19 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 (2 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-20040127574-A1 Aminoethanol derivatives CETP, LCAT, MTTP ALDH1A1 783/4885KDM4E 244/4885HPGD 3316/4885
US-20060100261-A1 Furan or thiopene derivative and medicinal use thereof TXN2, CYP11B2, CYP11B1 ALDH1A1 1096/4885KDM4E 3120/4885HPGD 507/4885

“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.