SCHEMBL4516055

SCHEMBL4516055

[NH]C(=S)Nc1cccc2ncccc12

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
ALDH1A1 P00352 7/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
LMNA P02545 1/20 0.57
HTT P42858 1/20 0.57
HDAC6 Q9UBN7 1/20 0.55
L3MBTL1 Q9Y468 3/20 0.54
PABPC1 P11940 3/20 0.54
EIF4H Q15056 3/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPT P10636 1/20 0.49

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
SCHEMBL4513908 0.88 PTPN1 (0.56) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL4511393 0.83 MEN1 (0.62) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL29653970 0.83 MEN1 (0.62) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL11233622 0.80 MEN1 (0.62) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL27599336 0.79 MEN1 (0.76) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL8620986 0.78 MEN1 (0.73) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL3314902 0.77 MEN1 (1.00) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL29728200 0.77 MEN1 (1.00) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL30645379 0.77 MEN1 (1.00) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL27599072 0.77 MEN1 (0.71) MEN1KMT2AALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233960-A1 Kinase Inhibitors DEVGEN NV (BE) 2009-09-17 US disclosed
EP-1934181-A2 KINASE INHIBITORS Devgen NV (BE) 2008-06-25 EP disclosed
WO-2007042321-A2 KINASE INHIBITORS DEVGEN N.V. (BE) 2007-04-19 WO 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-20090233960-A1 Kinase Inhibitors ROCK1, MAP3K1, MAP3K11 MEN1 732/4885KMT2A 3194/4885ALDH1A1 2810/4885

“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.