SCHEMBL28721117

SCHEMBL28721117

O=C(NC1CCC(N2CCN(C3CC(OC(F)(F)F)C3)C2=O)CC1)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
TSHR P16473 1/20 0.49
DPP4 P27487 7/20 0.46
DPP7 Q9UHL4 7/20 0.46
KCNH2 Q12809 4/20 0.46
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
CTSK P43235 1/20 0.45
EPHX1 P07099 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TLR4 O00206 1/20 0.43
HSD11B1 P28845 1/20 0.42
KDM1A O60341 1/20 0.42
MAOB P27338 1/20 0.42
GPR55 Q9Y2T6 1/20 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
SCHEMBL28721114 1.00 ALDH1A1 (0.51) ALDH1A1GAATSHRDPP4DPP7
SCHEMBL22614564 0.81 PDE7A (0.32)
SCHEMBL22614563 0.81 PDE7A (0.32)
SCHEMBL20064375 0.81 ALDH1A1 (0.58) ALDH1A1GAATSHRDPP4DPP7
SCHEMBL29140862 0.80 ALDH1A1 (0.60) ALDH1A1GAATSHRDPP4DPP7
SCHEMBL29409135 0.76 ALDH1A1 (0.45) ALDH1A1GAATSHRDPP4DPP7
SCHEMBL28723804 0.76 ALDH1A1 (0.45) ALDH1A1GAATSHRDPP4DPP7
SCHEMBL28721342 0.75 GAA (0.59) ALDH1A1GAATSHRDPP4DPP7
SCHEMBL28721339 0.75 GAA (0.59) ALDH1A1GAATSHRDPP4DPP7
SCHEMBL3948461 0.75 ALDH1A1 (0.85) ALDH1A1GAATSHRDPP4DPP7

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
US-20250145594-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2025-05-08 US disclosed
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
CN-114206848-A Substituted cycloalkyl compounds as modulators of integrated stress pathways 卡里科生命科学有限责任公司 2022-03-18 CN disclosed
EP-3962906-A1 SUBSTITUTED CYCLOALKYLS AS MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2022-03-09 EP 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-20250145594-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ALDH1A1 2882/4885GAA 1937/4885TSHR 3690/4885

“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.