SCHEMBL21044385

SCHEMBL21044385

CCOC(=O)C(CCOC)c1csc(NS(=O)(=O)C2CC2)n1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTPS1 P17812 14/20 0.44
CTPS2 Q9NRF8 2/20 0.42
PKM P14618 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GCK P35557 2/20 0.35

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
SCHEMBL21044071 0.89 CTPS1 (0.43) CTPS1CTPS2GCK
SCHEMBL21044594 0.88 CTPS1 (0.45) CTPS1CTPS2ALDH1A1CYP2C9CYP2C19
SCHEMBL22490745 0.84 CTPS1 (0.43) CTPS1CTPS2ALDH1A1GCK
SCHEMBL21044325 0.84 CTPS1 (0.46) CTPS1CTPS2ALDH1A1CYP2C9CYP2C19
SCHEMBL22490835 0.82 CTPS1 (0.42) CTPS1CTPS2GCK
SCHEMBL22491753 0.82 CTPS1 (0.45) CTPS1CTPS2ALDH1A1CYP2C9CYP2C19
SCHEMBL21044259 0.81 CTPS1 (0.44) CTPS1CTPS2ALDH1A1CYP2C9CYP2C19
SCHEMBL21044216 0.78 CTPS1 (0.46) CTPS1CTPS2GCK
SCHEMBL24088711 0.78 PTPRB (0.46) CTPS1CTPS2
SCHEMBL32663042 0.77 CTPS1 (0.44) CTPS1CTPS2GCK

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
EP-3717459-B1 COMPOUNDS STEP PHARMA S A S (FR) 2026-01-21 EP disclosed
US-11655246-B2 Aminothiazole compounds as inhibitors of CTPS1 STEP PHARMA S.A.S. (FR) 2023-05-23 US disclosed
US-11655246-B2 Aminothiazole compounds as inhibitors of CTPS1 STEP PHARMA S.A.S. (FR) 2023-05-23 US disclosed
US-20210002269-A1 COMPOUNDS STEP PHARMA S.A.S. (FR) 2021-01-07 US disclosed
EP-3492454-A1 COMPOUNDS Step Pharma S.A.S. (FR) 2019-06-05 EP disclosed
EP-3492454-A1 COMPOUNDS Step Pharma S.A.S. (FR) 2019-06-05 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 (2 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-11655246-B2 Aminothiazole compounds as inhibitors of CTPS1 CTPS1, CTPS2, TBXAS1 CTPS1 1/4885CTPS2 2/4885PKM 3594/4885
US-20210002269-A1 COMPOUNDS UGT1A1, CYP1A1, CYP19A1 CTPS1 2385/4885CTPS2 2441/4885PKM 1562/4885

“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.