SCHEMBL31369348

SCHEMBL31369348

COC(=O)CN(C(=O)C(F)(F)F)c1c(OCc2ccccc2)cc2c(c1F)C[C@H](NC(=O)OC(C)(C)C)CS2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
ACHE P22303 2/20 0.34
RORC P51449 4/20 0.34
PAX8 Q06710 2/20 0.33
PDE4B Q07343 1/20 0.32
CYP2C9 P11712 1/20 0.32
PTGER1 P34995 1/20 0.32
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32
SKP2 Q13309 1/20 0.32
KDM1A O60341 1/20 0.32
MAOB P27338 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
DRD2 P14416 1/20 0.31
SGMS2 Q8NHU3 1/20 0.31
KLK7 P49862 1/20 0.31

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
SCHEMBL29626333 0.86 KMT2A (0.36) KMT2AL3MBTL1CA1CA2ACHE
SCHEMBL31369351 0.86
SCHEMBL31369414 0.84 PTPN2 (0.30)
SCHEMBL29132485 0.82 CYP2C9 (0.33) KMT2AL3MBTL1RORCPAX8PDE4B
SCHEMBL30352483 0.82 KMT2A (0.39) KMT2AL3MBTL1CA1CA2ACHE
SCHEMBL25240007 0.81
SCHEMBL29626374 0.81 CYP2C9 (0.34) KMT2AL3MBTL1CA1CA2ACHE
SCHEMBL29626373 0.81 PDE4B (0.34) KMT2AL3MBTL1CA1CA2ACHE
SCHEMBL29626354 0.81 PDE4B (0.34) KMT2AL3MBTL1CA1CA2ACHE
SCHEMBL29132470 0.81 CYP2C9 (0.34) KMT2AL3MBTL1CA1CA2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250042894-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CALICO LIFE SCIENCES LLC 2025-02-06 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 (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-20250042894-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PTPN1, PTPN5, PTPN18 KMT2A 1677/4885L3MBTL1 3229/4885CA1 1904/4885

“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.