SCHEMBL23701236

SCHEMBL23701236

O=C(O)N1CCc2ccc(OCc3ccc(OCCF)cn3)cc2C1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.45
FFAR4 Q5NUL3 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ABHD6 Q9BV23 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
KMT2A Q03164 1/20 0.41
F10 P00742 6/20 0.41
S1PR1 P21453 1/20 0.39
PLG P00747 1/20 0.38

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
SCHEMBL23701473 0.92 HRH3 (0.42) HRH3FFAR4CYP4F2CYP4A11KMT2A
SCHEMBL23709369 0.87 NR1H2 (0.51) HRH3ABHD6CYP4F2CYP4A11
SCHEMBL23537968 0.86 ESR1 (0.46) HRH3ABHD6CYP4F2CYP4A11KMT2A
SCHEMBL23701302 0.85 ADRA2A (0.42) HRH3FFAR4CYP4F2CYP4A11KMT2A
SCHEMBL29097949 0.84 HRH3 (0.43) HRH3CYP4F2CYP4A11F10PLG
SCHEMBL23561748 0.83 STS (0.41) HRH3KMT2A
SCHEMBL29098045 0.80 F10 (0.52) HRH3HPGDTSHRSMN1; SMN2HSD17B10
SCHEMBL23561871 0.79 NR1H2 (0.53) HRH3ABHD6CYP4F2CYP4A11
SCHEMBL30951856 0.79 NR1H2 (0.53) HRH3ABHD6CYP4F2CYP4A11
SCHEMBL23561725 0.78 HRH3 (0.55) HRH3ABHD6KMT2AF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11992535-B2 Compounds and probes for imaging huntingtin protein CHDI FOUNDATION, INC. (US) 2024-05-28 US disclosed
US-20210236663-A1 COMPOUNDS AND PROBES FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. 2021-08-05 US 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 (2 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-20210236663-A1 COMPOUNDS AND PROBES FOR IMAGING HUNTINGTIN PROTEIN HTT, HYPK, HSPBP1 HRH3 3299/4885FFAR4 4102/4885HPGD 1947/4885
US-11992535-B2 Compounds and probes for imaging huntingtin protein HTT, HYPK, HSPBP1 HRH3 3299/4885FFAR4 4102/4885HPGD 1947/4885

“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.