SCHEMBL6447894

SCHEMBL6447894

O=C(OCC1CCCCC1)[C@@]1(C(F)(F)F)CO1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
MGLL Q99685 2/20 0.37
SLC1A3 P43003 3/20 0.36
SLC1A2 P43004 3/20 0.36
SLC1A1 P43005 3/20 0.36
PDK2 Q15119 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HDAC3 O15379 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC2 Q92769 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
THRA P10827 1/20 0.31
THRB P10828 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
SCHEMBL6447898 1.00 LMNA (0.41) LMNAMGLLSLC1A3SLC1A2SLC1A1
SCHEMBL6448452 0.86 EPHX1 (0.36) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL6448447 0.86 EPHX1 (0.36) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL6448054 0.76 NAAA (0.39) MEN1KMT2ASMN1; SMN2
SCHEMBL6448059 0.76 NAAA (0.39) MEN1KMT2ASMN1; SMN2
SCHEMBL6447041 0.73 ATM (0.47) LMNASMN1; SMN2
SCHEMBL6447044 0.73 ATM (0.47) LMNASMN1; SMN2
SCHEMBL6448274 0.72 EPHX1 (0.45) MEN1KMT2AHDAC3HDAC1
SCHEMBL8895551 0.72 LMNA (0.55) LMNASLC1A3SLC1A2SLC1A1MEN1
SCHEMBL9132826 0.72 LMNA (0.55) LMNASLC1A3SLC1A2SLC1A1MEN1

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-6921832-B2 Optically active fluorine-containing compounds and processes for their production TOSOH CORPORATION (JP) 2005-07-26 US disclosed
US-20040147756-A1 Optically active fluorine-containing compounds and processes for their production TOSOH CORPORATION (JP) 2004-07-29 US disclosed
EP-1422226-A1 Optically active fluorine-containing compounds and processes for their production Tosoh Corporation (JP) 2004-05-26 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-20040147756-A1 Optically active fluorine-containing compounds and processes for their production CYP2C19, CYP2F1, CYP2B6 LMNA 3125/4885MGLL 3160/4885SLC1A3 3035/4885

“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.