SCHEMBL990148

SCHEMBL990148

CN(C)S(=O)(=O)c1cccc2[nH]c(N)nc12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
NUDT1 P36639 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MASP2 O00187 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
AOC3 Q16853 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.39
PNP P00491 1/20 0.38
PARP1 P09874 2/20 0.38
HTT P42858 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36

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
SCHEMBL10960498 0.78 PSMB8 (0.52) POLBALDH1A1SMN1; SMN2PARP1HTT
SCHEMBL990150 0.77 POLB (0.48) POLBNUDT1ALDH1A1MASP2MEN1
SCHEMBL6209333 0.77 PNP (0.43) POLBNUDT1ALDH1A1PNP
SCHEMBL6212274 0.75 DHODH (0.40) POLBNUDT1ALDH1A1PNPHTT
SCHEMBL11166658 0.71 ABL1 (0.38) POLBNUDT1ALDH1A1SMN1; SMN2PNP
SCHEMBL9851232 0.71 POLB (0.48) POLBALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL4243602 0.70 GLO1 (0.51) NUDT1ALDH1A1MASP2MEN1KMT2A
SCHEMBL727228 0.70 MGAM (0.53) NUDT1ALDH1A1MASP2MEN1KMT2A
SCHEMBL19008538 0.69 NUDT1 (0.47) POLBNUDT1ALDH1A1MASP2MEN1
SCHEMBL8818596 0.69 NUDT1 (0.47) NUDT1ALDH1A1MASP2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7863310-B2 Kinase inhibitors ELI LILLY AND COMPANY (US) 2011-01-04 US disclosed
US-20080227839-A1 Kinase Inhibitors ELI LILLY AND COMPANY 2008-09-18 US disclosed
EP-1720862-A1 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2006-11-15 EP disclosed
WO-2005080380-A1 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2005-09-01 WO disclosed
EP-1554272-A1 BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE ELI LILLY AND COMPANY (US) 2005-07-20 EP disclosed
WO-2004014900-A1 BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE ELI LILLY AND COMPANY (US) 2004-02-19 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-20080227839-A1 Kinase Inhibitors ABL1, MAP3K20, MAP3K19 POLB 1551/4885NUDT1 3134/4885ALDH1A1 3631/4885

“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.