SCHEMBL23462010

SCHEMBL23462010

CCOC(=O)c1cc(C(C)(C)C)oc1C(=O)OCC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.67
ALDH1A1 P00352 5/20 0.49
LMNA P02545 2/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
L3MBTL1 Q9Y468 4/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MAPT P10636 2/20 0.46
TSHR P16473 2/20 0.44
POLB P06746 1/20 0.44
TP53 P04637 1/20 0.43
FUCA1 P04066 2/20 0.42
GLB1 P16278 1/20 0.42
GAA P10253 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41

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
SCHEMBL3113960 0.85 MAPK1 (0.68) MAPK1ALDH1A1LMNAKMT2AL3MBTL1
SCHEMBL3244907 0.83 MAPK1 (0.57) MAPK1ALDH1A1LMNAMEN1KMT2A
SCHEMBL23462185 0.80 TSHR (0.50) MAPK1ALDH1A1LMNAKMT2AL3MBTL1
SCHEMBL23462064 0.78 MAPK14 (0.51) MAPK1ALDH1A1LMNAMEN1KMT2A
SCHEMBL2088892 0.75 TSHR (0.46) MAPK1ALDH1A1LMNAKMT2AL3MBTL1
SCHEMBL842992 0.72 MAPK1 (0.52) MAPK1ALDH1A1LMNAMEN1KMT2A
SCHEMBL15211230 0.71 MAPK1 (0.51) MAPK1ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL346578 0.70 TSHR (0.67) MAPK1ALDH1A1LMNAMEN1KMT2A
SCHEMBL352509 0.69 MAPK1 (0.49) MAPK1ALDH1A1LMNAMEN1KMT2A
SCHEMBL1980103 0.69 MAPK1 (0.49) MAPK1ALDH1A1LMNAMEN1KMT2A

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
US-20220402925-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB LLC (US) 2022-12-22 US disclosed
EP-4069216-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS Flatley Discovery Lab, LLC (US) 2022-10-12 EP disclosed
WO-2021113795-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB, LLC (US) 2021-06-10 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 (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-20220402925-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, ABCB11, SERPINB1 MAPK1 2849/4885ALDH1A1 814/4885LMNA 1983/4885

“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.