SCHEMBL10076207

SCHEMBL10076207

CCc1cccc(NC(=O)C2CCCNC2)c1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.74
F10 P00742 1/20 0.59
AURKA O14965 1/20 0.55
AURKB Q96GD4 1/20 0.55
ALOX15 P16050 1/20 0.53
ULK1 O75385 1/20 0.52
MAPT P10636 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
RHOA P61586 1/20 0.51
KHK P50053 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 1/20 0.48
TNKS O95271 1/20 0.47
TNKS2 Q9H2K2 1/20 0.47

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
SCHEMBL18073044 0.88 F10 (0.59) SMN1; SMN2F10AURKAAURKBALOX15
SCHEMBL10076298 0.87 SMN1; SMN2 (0.54) SMN1; SMN2F10AURKAAURKBALOX15
SCHEMBL21240932 0.86 SMN1; SMN2 (0.94) SMN1; SMN2MAPTMEN1KMT2ATDP1
SCHEMBL20425994 0.85 SMN1; SMN2 (0.56) SMN1; SMN2F10AURKAAURKBALOX15
SCHEMBL8298268 0.84 SMN1; SMN2 (0.97) SMN1; SMN2MAPTMEN1KMT2ATDP1
SCHEMBL259381 0.84 NPSR1 (0.72) SMN1; SMN2F10ALOX15ULK1KHK
SCHEMBL18774005 0.83 SMN1; SMN2 (0.89) SMN1; SMN2MAPTMEN1KMT2ATDP1
SCHEMBL2449231 0.81 F10 (0.56) SMN1; SMN2F10ALOX15ULK1MAPT
SCHEMBL2452221 0.81 F10 (0.56) SMN1; SMN2F10ALOX15ULK1MEN1
SCHEMBL24016844 0.81 RXFP1 (0.59) SMN1; SMN2F10ALOX15ULK1KHK

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-8093231-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2012-01-10 US disclosed
US-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES TELIK, INC. 2008-02-14 US disclosed
US-7262182-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2007-08-28 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-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES MTAP, TYMP, PHOSPHO1 SMN1; SMN2 1097/4885F10 4075/4885AURKA 1175/4885

“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.