SCHEMBL22762634

SCHEMBL22762634

CSc1nccc(C2(CO)CCOCC2)n1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.35
▸ RAF1 P04049 4/20 0.33
▸ MAPK13 O15264 1/20 0.32
▸ MAPK12 P53778 1/20 0.32
▸ MAPK11 Q15759 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ PARP1 P09874 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ ALOX5 P09917 1/20 0.30
▸ ALOX15 P16050 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
SCHEMBL29791207 0.79 CTPS1 (0.40) LMNAALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL22749305 0.78 LMNA (0.36) LMNAALDH1A1GAAMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL29368124 0.77 LMNA (0.35) LMNAALDH1A1GAAMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL28701070 0.77 LMNA (0.35) LMNAALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL22758556 0.77 FFAR4 (0.39) LMNAALDH1A1GAAMAPTSMN1; SMN2
Lithium SCHEMBL30725900 0.76 FFAR4 (0.38) LMNAALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL29142075 0.76 FFAR4 (0.38) LMNAALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL21392085 0.75 FFAR4 (0.35) LMNAALDH1A1GAAMAPTSMN1; SMN2
Lithium Ion SCHEMBL22749301 0.75 FFAR4 (0.35) LMNAALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL20137350 0.74 LMNA (0.34) LMNAALDH1A1GAAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230086703-A1 N-(4-(5-chloropyridin-3-yl)phenyl)-2-(2-(cyclopropanesulfonamido)pyrimidin-4-yl) butanamide derivatives and related compounds as human CTPS1 inhibitors for the treatment of proliferative diseases STEP PHARMA S.A.S. (FR) 2023-03-23 — — US disclosed
US-20230020663-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2023-01-19 — — US disclosed
US-20230020663-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2023-01-19 — — US disclosed
US-20230002352-A1 SULFONAMIDE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2023-01-05 — — US disclosed
US-20230002352-A1 SULFONAMIDE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2023-01-05 — — US disclosed
EP-4041723-A2 SULFONAMIDE DERIVATIVES AS CTPS1 INHIBITORS Step Pharma S.A.S. (FR) 2022-08-17 — — EP disclosed
EP-4041715-A1 SULFONAMIDE INHIBITORS AS CTPS 1 INHIBITORS Step Pharma S.A.S. (FR) 2022-08-17 — — EP disclosed
EP-3980410-A1 N-(4-(5-CHLOROPYRIDIN-3-YL)PHENYL)-2-(2-(CYCLOPROPANESULFONAMIDO)PYRIMIDIN-4-YL) BUTANAMIDE DERIVATIVES AND RELATED COMPOUNDS AS HUMAN CTPS1 INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISEASES Step Pharma S.A.S. (FR) 2022-04-13 — — EP disclosed
WO-2021053403-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2021-03-25 — — WO disclosed
WO-2021053402-A2 COMPOUNDS STEP PHARMA S.A.S. (FR) 2021-03-25 — — WO disclosed
WO-2020245665-A1 N-(4-(5-CHLOROPYRIDIN-3-YL)PHENYL)-2-(2-(CYCLOPROPANESULFONAMIDO)PYRIMIDIN-4-YL) BUTANAMIDE DERIVATIVES AND RELATED COMPOUNDS AS HUMAN CTPS1 INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISEASES STEP PHARMA S.A.S. (FR) 2020-12-10 — — 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 (3 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-20230020663-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS CTPS1, CTPS2, TYMS LMNA 2653/4885ALDH1A1 1517/4885GAA 974/4885
US-20230086703-A1 N-(4-(5-chloropyridin-3-yl)phenyl)-2-(2-(cyclopropanesulfonamido)pyrimidin-4-yl) butanamide derivatives and related compounds as human CTPS1 inhibitors for the treatment of proliferative diseases CTPS1, CTPS2, CERS2 LMNA 1330/4885ALDH1A1 2214/4885GAA 1324/4885
US-20230002352-A1 SULFONAMIDE DERIVATIVES AS CTPS1 INHIBITORS CTPS1, CTPS2, TYMS LMNA 3170/4885ALDH1A1 978/4885GAA 1223/4885

“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.

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