SCHEMBL4516142

SCHEMBL4516142

[NH]C(=S)Nc1ccccc1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.57
ALDH1A1 P00352 5/20 0.50
MEN1 O00255 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
SIGMAR1 Q99720 1/20 0.49
HTT P42858 2/20 0.46
MAPT P10636 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TSHR P16473 1/20 0.46
LMNA P02545 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ATM Q13315 1/20 0.45
FABP3 P05413 1/20 0.44
FABP4 P15090 1/20 0.44
FABP5 Q01469 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SOAT1 P35610 2/20 0.44

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
SCHEMBL9178752 0.83 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL1385783 0.82 ALDH1A1 (0.61) ALDH1A1MEN1CYP2C9HPGDKMT2A
SCHEMBL9311653 0.80 SIGMAR1 (0.57) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL3609789 0.80 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL9313159 0.79 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL27609154 0.78 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL9311637 0.77 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL30568040 0.76 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL28115195 0.76 SIGMAR1 (0.57) SMN1; SMN2ALDH1A1MEN1CYP2C9HPGD
SCHEMBL265014 0.75 ALDH1A1 (0.62) ALDH1A1MEN1CYP2C9HPGDKMT2A

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 SMN1; SMN2 3162/4885ALDH1A1 2810/4885MEN1 732/4885

“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.