SCHEMBL26968664

SCHEMBL26968664

CC(=O)CCC(C(=O)O)C(=O)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
SLC15A2 Q16348 1/20 0.36
FOLH1 Q04609 1/20 0.32
CYP1A2 P05177 1/20 0.31
NOS2 P35228 3/20 0.31
NOS3 P29474 2/20 0.31
NOS1 P29475 2/20 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
SCHEMBL26968700 0.80 ALDH1A1 (0.34) ALDH1A1LMNA
SCHEMBL1421677 0.79 ALDH1A1 (0.50) ALDH1A1LMNASLC15A2FOLH1CYP1A2
SCHEMBL499963 0.78 CHRM1 (0.46) CYP1A2
SCHEMBL9569276 0.78 ALDH1A1 (0.39) ALDH1A1
SCHEMBL20680195 0.75 CA2 (0.47) CYP1A2
SCHEMBL9464835 0.75 ALDH1A1 (0.45) ALDH1A1LMNASLC15A2FOLH1CYP1A2
SCHEMBL166047 0.73 MAPT (0.35) CYP1A2
SCHEMBL10697627 0.72 MAPT (0.55) CYP1A2
SCHEMBL7147426 0.71 LMNA (0.34) ALDH1A1LMNACYP1A2
SCHEMBL15194246 0.70 THRB (0.42) ALDH1A1

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-20240158328-A1 METHOD FOR PRODUCING CYCLOHEXENONE COMPOUND API CORPORATION (JP) 2024-05-16 US disclosed
EP-4296254-A1 METHOD FOR PRODUCING CYCLOHEXENONE COMPOUND API Corporation (JP) 2023-12-27 EP disclosed
WO-2022176837-A1 METHOD FOR PRODUCING CYCLOHEXENONE COMPOUND 株式会社エーピーアイ コーポレーション 2022-08-25 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-20240158328-A1 METHOD FOR PRODUCING CYCLOHEXENONE COMPOUND CYP4A11, HSD17B7, CYP51A1 ALDH1A1 938/4885LMNA 1448/4885SLC15A2 4634/4885

“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.