SCHEMBL446777

SCHEMBL446777

CCNC(=S)N(NC(=O)CS(=O)(=O)N(CC)N(C(N)=S)c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.33
HPGD P15428 1/20 0.33
KDM4E B2RXH2 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.32
MAPT P10636 3/20 0.32
HTT P42858 2/20 0.32
ALOX12 P18054 1/20 0.32
GFER P55789 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
LMNA P02545 1/20 0.31
ABCC1 P33527 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
TSHR P16473 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
GAA P10253 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL464694 0.78 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2HPGDKDM4EL3MBTL1
SCHEMBL446038 0.69
SCHEMBL5674851 0.68 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2HPGDKDM4EL3MBTL1
SCHEMBL448376 0.67 LMNA (0.39) ALDH1A1SMN1; SMN2HPGDL3MBTL1MAPT
SCHEMBL449405 0.66 HSP90AA1 (0.54) ALDH1A1SMN1; SMN2KDM4EMAPTKMT2A
SCHEMBL7640151 0.63 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2HPGDKDM4EL3MBTL1
SCHEMBL447594 0.62
SCHEMBL3808721 0.61 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTTDP1LMNA
SCHEMBL7987611 0.61 L3MBTL1 (0.73) ALDH1A1SMN1; SMN2HPGDKDM4EL3MBTL1
SCHEMBL10049995 0.60 HSP90AA1 (0.51) ALDH1A1SMN1; SMN2HPGDKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680100-B2 Sulfonylhydrazide compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2014-03-25 US disclosed
US-20120065206-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2012-03-15 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-20120065206-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS PKD1, PKD2, PCNA ALDH1A1 1351/4885SMN1; SMN2 2833/4885HPGD 624/4885

“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.