SCHEMBL29132482

SCHEMBL29132482

CC(C)(C)OC(=O)N[C@@H]1CCc2cc(OCc3ccccc3)c(Br)c(F)c2C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
ACHE P22303 2/20 0.46
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM1A O60341 1/20 0.40
MAOB P27338 1/20 0.40
TAOK1 Q7L7X3 1/20 0.39
TAOK3 Q9H2K8 1/20 0.39
RORC P51449 2/20 0.39
SCN9A Q15858 1/20 0.39
DRD2 P14416 2/20 0.38
PDE4B Q07343 1/20 0.38
KCNA3 P22001 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
PAX8 Q06710 1/20 0.38
EPHX2 P34913 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL28934875 0.90 CA1 (0.56) CA1CA2ACHEKMT2ATAOK1
SCHEMBL22412174 0.89 CA1 (0.44) CA1CA2ACHEKMT2ATAOK1
SCHEMBL25338361 0.86 CA1 (0.44) CA1CA2ACHEKMT2AL3MBTL1
SCHEMBL29626301 0.86 ACACB (0.41) DRD2NPY5R
SCHEMBL29626234 0.85 CA1 (0.43) CA1CA2ACHEKMT2AL3MBTL1
SCHEMBL29132503 0.85 CA1 (0.43) CA1CA2ACHEKMT2AL3MBTL1
SCHEMBL22412225 0.81 CA1 (0.50) CA1CA2ACHETAOK1TAOK3
SCHEMBL22412223 0.81 CA1 (0.50) CA1CA2ACHETAOK1TAOK3
SCHEMBL29626370 0.81 CA1 (0.50) CA1CA2ACHETAOK1TAOK3
SCHEMBL25338586 0.78 ITGB3 (0.43) KMT2AKDM1AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250122160-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CALICO LIFE SCIENCES LLC (US) 2025-04-17 US disclosed
CN-116829555-A Protein tyrosine phosphatase inhibitors and methods of use thereof 卡里科生命科学有限责任公司 2023-09-29 CN disclosed
EP-4211122-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF Calico Life Sciences LLC (US) 2023-07-19 EP disclosed
WO-2022056281-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CALICO LIFE SCIENCES LLC (US) 2022-03-17 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 (1 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-20250122160-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PTPN1, PTPN2, PTPN18 CA1 4547/4885CA2 2713/4885ACHE 4771/4885

“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.