SCHEMBL22490735

SCHEMBL22490735

CC(C)c1c(C(N)=O)cccc1-c1cscn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.46
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
CHEK2 O96017 1/20 0.38
BCAT2 O15382 1/20 0.37
SYK P43405 2/20 0.37
IDO1 P14902 2/20 0.36
TDO2 P48775 1/20 0.35
CTSA P10619 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
CSNK1A1 P48729 1/20 0.34
TYRO3 Q06418 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
KDM4A O75164 1/20 0.34
KDM4B O94953 1/20 0.34
KDM5C P41229 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
HTT P42858 1/20 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
SCHEMBL31676657 1.00 PARP1 (0.46) PARP1KEAP1NFE2L2CHEK2BCAT2
SCHEMBL1724612 0.82 PARP1 (0.48) PARP1KEAP1NFE2L2CHEK2BCAT2
SCHEMBL27559308 0.81 BCAT2 (0.53) PARP1KEAP1NFE2L2CHEK2BCAT2
SCHEMBL30042190 0.81 BCAT2 (0.53) PARP1KEAP1NFE2L2CHEK2BCAT2
SCHEMBL22490734 0.78 PARP1 (0.46) PARP1KEAP1NFE2L2CHEK2SYK
SCHEMBL21381430 0.76 JAK2 (0.41) PARP1KEAP1NFE2L2BCAT2CSNK1A1
SCHEMBL30882864 0.76 JAK2 (0.41) PARP1KEAP1NFE2L2BCAT2CSNK1A1
SCHEMBL2977145 0.74 IRAK4 (0.50) PARP1KEAP1NFE2L2BCAT2IRAK4
SCHEMBL4068668 0.72 BCAT2 (0.62) PARP1KEAP1NFE2L2BCAT2IRAK4
SCHEMBL251448 0.71 PARP1 (0.44) PARP1KEAP1NFE2L2CHEK2BCAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3717465-B1 COMPOUNDS STEP PHARMA S A S (FR) 2026-01-21 EP disclosed
US-20250263407-A1 Compounds STEP PHARMA S.A.S. (FR) 2025-08-21 US disclosed
US-12319680-B2 Compounds STEP PHARMA S.A.S. (FR) 2025-06-03 US disclosed
US-20230183229-A1 Compounds SYGNATURE DISCOVERY LIMITED (GB) 2023-06-15 US disclosed
US-11505547-B2 Compounds STEP PHARMA S.A.S. (FR) 2022-11-22 US disclosed
US-20210380575-A1 COMPOUNDS SYGNATURE DISCOVERY LIMITED (GB) 2021-12-09 US disclosed
EP-3717465-A1 COMPOUNDS Step Pharma S.A.S. (FR) 2020-10-07 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 (5 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-20230183229-A1 Compounds UGT1A1, CYP1A1, CYP1B1 PARP1 1584/4885KEAP1 276/4885NFE2L2 180/4885
US-12319680-B2 Compounds UGT1A1, CYP1A1, CYP1B1 PARP1 1584/4885KEAP1 276/4885NFE2L2 180/4885
US-20250263407-A1 Compounds CYP1A1, UGT1A1, CYP1A2 PARP1 1430/4885KEAP1 333/4885NFE2L2 186/4885
US-11505547-B2 Compounds UGT1A1, CYP1A1, CYP1B1 PARP1 1584/4885KEAP1 276/4885NFE2L2 180/4885
US-20210380575-A1 COMPOUNDS UGT1A1, CYP1A1, CYP1B1 PARP1 1584/4885KEAP1 276/4885NFE2L2 180/4885

“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.