SCHEMBL24513784

SCHEMBL24513784

O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCO[C@H](CO)C1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.49
HIF1A Q16665 1/20 0.45
RHOA P61586 7/20 0.44
RHOC P08134 3/20 0.44
TSHR P16473 5/20 0.44
CYP3A4 P08684 5/20 0.44
USP2 O75604 5/20 0.44
CYP2C19 P33261 2/20 0.44
PDK1 Q15118 1/20 0.43
CYP2C9 P11712 2/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2D6 P10635 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GLRA1 P23415 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
SCHEMBL24513571 1.00 SCN9A (0.49) SCN9AHIF1ARHOARHOCTSHR
SCHEMBL24548420 0.85 PDK1 (0.48) SCN9AHIF1ARHOARHOCTSHR
SCHEMBL24548421 0.85 PDK1 (0.48) SCN9AHIF1ARHOARHOCTSHR
SCHEMBL24513565 0.79 SCN9A (0.40) SCN9AHIF1ARHOARHOCTSHR
SCHEMBL30691979 0.76 HIF1A (0.58) HIF1ATSHRCYP3A4USP2CYP2C19
SCHEMBL1534232 0.75 RHOA (0.54) RHOARHOCCYP3A4
SCHEMBL13725365 0.75 PDK1 (0.47) SCN9APDK1
SCHEMBL3984592 0.75 PDK1 (0.47) SCN9APDK1GLRA1
SCHEMBL10264841 0.72 HSP90AA1 (0.65)
SCHEMBL30691969 0.71 HIF1A (0.50) HIF1ATSHRCYP3A4USP2CYP2C19

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-20220195437-A1 TAU-TARGETING OLIGONUCLEOTIDE GAPMERS EISAI R&D MANAGEMENT CO., LTD. (JP) 2022-06-23 US disclosed
WO-2022125984-A1 TAU-TARGETING OLIGONUCLEOTIDE GAPMERS EISAI R&D MANAGEMENT CO., LTD. (JP) 2022-06-16 WO disclosed
WO-2022125987-A1 POLY-MORPHOLINO OLIGONUCLEOTIDE GAPMERS EISAI R&D MANAGEMENT CO., LTD. (JP) 2022-06-16 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-20220195437-A1 TAU-TARGETING OLIGONUCLEOTIDE GAPMERS MAPT, GAP43, RNMT SCN9A 2397/4885HIF1A 3944/4885RHOA 1817/4885

“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.