SCHEMBL23701210

SCHEMBL23701210

COc1ccc(OCCOc2ccc3c(c2)CN(C(=O)O)CC3)nc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.49
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
KMT2A Q03164 2/20 0.44
TAAR1 Q96RJ0 1/20 0.44
F10 P00742 6/20 0.44
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
ABHD6 Q9BV23 1/20 0.41
GPR84 Q9NQS5 1/20 0.41
PLG P00747 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
SCHEMBL30951857 0.87 NR1H2 (0.53) HRH3ESR1ESR2KMT2ATAAR1
SCHEMBL23701350 0.87 CA1 (0.48) HRH3KMT2AMEN1MAPTOPRM1
SCHEMBL30014279 0.87 CA1 (0.48) HRH3KMT2AMEN1MAPTOPRM1
SCHEMBL23709312 0.87 NR1H2 (0.53) HRH3ESR1ESR2KMT2ATAAR1
SCHEMBL28533346 0.84 HRH3 (0.57) HRH3ESR1ESR2KMT2ATAAR1
SCHEMBL23537968 0.84 ESR1 (0.46) HRH3ESR1ESR2KMT2ATAAR1
SCHEMBL5137232 0.81 HRH3 (0.58) HRH3KMT2AF10ABHD6
SCHEMBL31553208 0.80 NR1H2 (0.46) HRH3ESR1ESR2KMT2AMAPT
SCHEMBL28539714 0.79 ESR1 (0.52) HRH3ESR1ESR2KMT2ATAAR1
SCHEMBL30290475 0.78 HRH3 (0.52) HRH3ESR1ESR2KMT2ATAAR1

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 3299/4885ESR1 4197/4885ESR2 3214/4885
US-11992535-B2 Compounds and probes for imaging huntingtin protein HTT, HYPK, HSPBP1 HRH3 3299/4885ESR1 4197/4885ESR2 3214/4885

“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.