SCHEMBL4265247

SCHEMBL4265247

Nc1cnn(Cc2ccccc2)c1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.49
RECQL P46063 1/20 0.49
ALDH1A1 P00352 4/20 0.47
GAA P10253 2/20 0.46
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
CYP19A1 P11511 1/20 0.44
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
ALOX15 P16050 1/20 0.42
CASP3 P42574 1/20 0.42
NR1H3 Q13133 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
MAPT P10636 3/20 0.42
PTGS1 P23219 1/20 0.42

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
SCHEMBL144813 0.80 TSHR (0.69) TSHRSMN1; SMN2RECQLALDH1A1GAA
SCHEMBL31276324 0.79 RECQL (0.49) TSHRSMN1; SMN2RECQLALDH1A1GAA
SCHEMBL5393696 0.79 RECQL (0.49) TSHRSMN1; SMN2RECQLALDH1A1GAA
SCHEMBL14858163 0.79 RECQL (0.49) TSHRSMN1; SMN2RECQLALDH1A1GAA
SCHEMBL10207174 0.78 PTGS1 (0.41) TSHRSMN1; SMN2ALDH1A1L3MBTL1LMNA
SCHEMBL17619656 0.77 TSHR (0.65) TSHRSMN1; SMN2RECQLALDH1A1GAA
SCHEMBL543833 0.77 PTGS2 (0.41) TSHRSMN1; SMN2POLBHPGDNR1H3
SCHEMBL5381957 0.77 RECQL (0.46) TSHRSMN1; SMN2RECQLALDH1A1GAA
SCHEMBL3493878 0.76 ALDH1A1 (0.54) TSHRRECQLALDH1A1POLBL3MBTL1
SCHEMBL5380556 0.76 SMN1; SMN2 (0.48) TSHRSMN1; SMN2RECQLALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048258-A1 Amide Compound TAKEDA, PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
US-20090048258-A1 Amide Compound TAKEDA, PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
US-20090048258-A1 Amide Compound TAKEDA, PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
EP-1845081-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-10-17 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-20090048258-A1 Amide Compound DLAT, DGAT1, DGAT2 TSHR 1327/4885SMN1; SMN2 4473/4885RECQL 4054/4885

“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.