SCHEMBL22613895

SCHEMBL22613895

O=C(O)NC1CCC(C(=O)NC2CC(OC(F)(F)F)C2)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
PKM P14618 1/20 0.36
EPHX2 P34913 3/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.31
LMNA P02545 1/20 0.31
TACR1 P25103 1/20 0.31
PIK3CD O00329 1/20 0.31
JAK2 O60674 2/20 0.30
JAK1 P23458 2/20 0.30
TYK2 P29597 2/20 0.30
JAK3 P52333 2/20 0.30

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
SCHEMBL22613894 1.00 POLB (0.40) POLBPKMEPHX2HSD17B10L3MBTL1
SCHEMBL22412611 0.86 PKM (0.33) PKM
SCHEMBL22412612 0.86 PKM (0.33) PKM
SCHEMBL28720053 0.82 BTK (0.46) POLBL3MBTL1KMT2A
SCHEMBL28720056 0.82 BTK (0.46) POLBL3MBTL1KMT2A
SCHEMBL23573569 0.79 POLB (0.59) POLBEPHX2HSD17B10L3MBTL1MAPK1
SCHEMBL3196032 0.79 POLB (0.59) POLBEPHX2HSD17B10L3MBTL1MAPK1
SCHEMBL23573567 0.79 POLB (0.59) POLBEPHX2HSD17B10L3MBTL1MAPK1
SCHEMBL3196038 0.79 POLB (0.59) POLBEPHX2HSD17B10L3MBTL1MAPK1
SCHEMBL23573549 0.71 POLB (0.50) POLBEPHX2L3MBTL1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4237413-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2023-09-06 EP disclosed
WO-2022094244-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2022-05-05 WO disclosed
EP-3962906-A1 SUBSTITUTED CYCLOALKYLS AS MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2022-03-09 EP disclosed
US-20200347043-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-05 US disclosed
WO-2020223538-A1 SUBSTITUTED CYCLOALKYLS AS MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2020-11-05 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-20200347043-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 POLB 1759/4885PKM 616/4885EPHX2 3920/4885

“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.