SCHEMBL9487307

SCHEMBL9487307

O=C(NCCc1ccc(CBr)cc1)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HTT P42858 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.53
MAPT P10636 1/20 0.53
TGM2 P21980 1/20 0.52
KEAP1 Q14145 2/20 0.51
NFE2L2 Q16236 2/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
NCOR2 Q9Y618 1/20 0.51

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
Benzyl Phenethylcarbamate SCHEMBL4287199 0.91 LMNA (0.73) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL10305302 0.88 LMNA (0.61) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL6554125 0.88 LMNA (0.65) LMNASMN1; SMN2HTTL3MBTL1MAPT
Benzyl Phenethylcarbamate SCHEMBL6392045 0.86 LMNA (0.67) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL160715 0.85 LMNA (0.61) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL2851561 0.85 LMNA (0.61) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL13884390 0.85 LMNA (0.61) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL8802503 0.85 LMNA (0.61) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL23291312 0.84 MAPT (0.66) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL6748819 0.83 HTT (0.72) LMNASMN1; SMN2HTTL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1876179-B1 Thienopyrimidone compounds TAKEDA PHARMACEUTICAL (JP) 2015-03-25 EP disclosed
US-7989445-B2 Thienopyrimidone compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-02 US disclosed
US-7989445-B2 Thienopyrimidone compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-02 US disclosed
US-20100069362-A1 Thienopyrimidone compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-18 US disclosed
US-20100069362-A1 Thienopyrimidone compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-18 US disclosed
EP-1876179-A1 THIENOPYRIMIDONE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-01-09 EP disclosed
US-5250426-A Catalytic hydrolysis using monoclonal antibodies THE SCRIPPS RESEARCH INSTITUTE (US) 1993-10-05 US 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-20100069362-A1 Thienopyrimidone compound MC1R, MC2R, MC5R LMNA 4733/4885SMN1; SMN2 3933/4885HTT 791/4885

“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.