SCHEMBL21664265

SCHEMBL21664265

COCCS(=O)(=O)NCC1CCCN(c2ncnc3cc(F)c(C#N)cc23)C1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 8/20 0.47
▸ PRKDC P78527 2/20 0.39
▸ PDE10A Q9Y233 2/20 0.39
▸ LRRK2 Q5S007 1/20 0.38
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ PDGFRB P09619 2/20 0.37
▸ PDE3A Q14432 3/20 0.37
▸ IRAK4 Q9NWZ3 1/20 0.37
▸ PDE3B Q13370 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
SCHEMBL21664270 0.90 ENPP1 (0.47) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL24064736 0.88 ENPP1 (0.46) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL21664293 0.87 ENPP1 (0.47) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL21664351 0.87 ENPP1 (0.47) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL30562936 0.87 ENPP1 (0.47) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL21664352 0.87 ENPP1 (0.47) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL21664269 0.87 ENPP1 (0.45) ENPP1PRKDCPDE10ALRRK2JAK2
Hydrochloric Acid SCHEMBL30562912 0.87 ENPP1 (0.47) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL21664325 0.86 ENPP1 (0.46) ENPP1PRKDCPDE10ALRRK2JAK2
SCHEMBL21664267 0.85 ENPP1 (0.42) ENPP1PRKDCPDE10AJAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3551188-B1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS SOUTHERN RES INST (US) 2023-10-18 — — EP disclosed
US-11752153-B2 Substituted quinazoline sulfonamides as thioredoxin interacting protein (TXNIP) inhibitors SOUTHERN RESEARCH INSTITUTE (US) 2023-09-12 — — US disclosed
US-20200038402-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-02-06 — — US 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-20200038402-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS TXN, TXN2, TXNRD1 ENPP1 2457/4885PRKDC 4070/4885PDE10A 3040/4885
US-11752153-B2 Substituted quinazoline sulfonamides as thioredoxin interacting protein (TXNIP) inhibitors TXN, TXNL1, TXN2 ENPP1 2704/4885PRKDC 4313/4885PDE10A 2758/4885

“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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