SCHEMBL15520108

SCHEMBL15520108

CS(=O)(=O)CCNCc1ccc2[nH]c(-c3cc(N)c[nH]c3=O)cc2c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 3/20 0.36
CHEK1 O14757 8/20 0.36
SLC2A1 P11166 2/20 0.35
EGFR P00533 1/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 1/20 0.34
IL6 P05231 2/20 0.34
HTR2A P28223 1/20 0.33
PPARG P37231 1/20 0.33
FFAR1 O14842 2/20 0.33

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
SCHEMBL15520640 0.86 CHEK1 (0.38) CHEK1MAPTKDM4EALDH1A1PPARG
SCHEMBL15520027 0.86 MAPT (0.42) CHEK1MAPTKDM4ETDP1ALDH1A1
SCHEMBL15520105 0.77 CHEK1 (0.39) CHEK1SLC2A1EGFRMAPTKDM4E
SCHEMBL15520686 0.75 FFAR1 (0.37) CHEK1FFAR1
SCHEMBL950167 0.75 RPS6KA3 (0.40) ALDH1A1
SCHEMBL15520107 0.74 CHEK1 (0.36) TLR7CHEK1EGFRMAPTKDM4E
SCHEMBL16616576 0.73 CHEK1 (0.46) CHEK1MAPTKDM4EALDH1A1PPARG
SCHEMBL15520772 0.73 PARP1 (0.39) CHEK1KDM4EALDH1A1FFAR1
SCHEMBL15519907 0.72 CHEK1 (0.64) CHEK1
SCHEMBL15520167 0.72 PARP1 (0.40) CHEK1KDM4EALDH1A1PPARGFFAR1

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-20200361905-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS R&D LTD (GB) 2020-11-19 US disclosed
US-10696652-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD. (GB) 2020-06-30 US disclosed
US-20180244652-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD. (GB) 2018-08-30 US disclosed
US-20170298043-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD. (GB) 2017-10-19 US disclosed
US-8916591-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD (GB) 2014-12-23 US disclosed
EP-2294065-B1 INDOLYL-PYRIDONE DERIVATIVES HAVING CHECKPOINT KINASE 1 INHIBITORY ACTIVITY VERNALIS R&D LTD (GB) 2014-03-19 EP 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 (4 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-20170298043-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK1, CHEK2, RAD1 TLR7 2138/4885CHEK1 1/4885SLC2A1 4720/4885
US-20200361905-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK2, CHEK1, BUB1B TLR7 1807/4885CHEK1 2/4885SLC2A1 4078/4885
US-10696652-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity CHEK2, CHEK1, BUB1B TLR7 1807/4885CHEK1 2/4885SLC2A1 4078/4885
US-20180244652-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK2, CHEK1, BUB1B TLR7 1807/4885CHEK1 2/4885SLC2A1 4078/4885

“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.