SCHEMBL17552126

SCHEMBL17552126

CC(C)(C)OC(=O)N1CCc2oc(C=O)cc2C1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.52
NR1H2 P55055 3/20 0.51
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43
HDAC1 Q13547 1/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ADORA1 P30542 1/20 0.38
NAMPT P43490 3/20 0.38
HPGDS O60760 1/20 0.38
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL12486360 0.76 ADORA1 (0.48) ESR2NR1H2MAPTMAPK1SMN1; SMN2
SCHEMBL322105 0.76 ESR2 (0.60) ESR2NR1H2MAPTMAPK1NAMPT
SCHEMBL320686 0.75 ESR2 (0.50) ESR2NR1H2MAPTMAPK1HDAC1
SCHEMBL3551446 0.75 ABHD6 (0.36) ESR2NR1H2MAPTMAPK1
SCHEMBL2732372 0.74 ESR2 (0.56) ESR2NR1H2MAPTMAPK1HDAC1
SCHEMBL31387247 0.74 ESR2 (0.53) ESR2NR1H2MAPTMAPK1USP2
SCHEMBL14101204 0.73 NR1H2 (0.69) ESR2NR1H2MAPTMAPK1HDAC1
SCHEMBL2923721 0.73 ESR2 (0.53) ESR2NR1H2MAPTMAPK1HDAC1
SCHEMBL2222982 0.73 ESR2 (0.70) ESR2NR1H2MAPTMAPK1HDAC1
SCHEMBL31084557 0.73 ESR2 (0.70) ESR2NR1H2MAPTMAPK1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11851446-B2 Probes for imaging Huntingtin protein CHDI FOUNDATION, INC. (US) 2023-12-26 US disclosed
EP-3197277-B1 PROBES FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION INC (US) 2021-12-22 EP disclosed
US-20170283439-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN CCHDI Foundation Inc. (US) 2017-10-05 US disclosed
US-20170283439-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN CCHDI Foundation Inc. (US) 2017-10-05 US disclosed
WO-2016033440-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. (US) 2016-03-03 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 (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-11851446-B2 Probes for imaging Huntingtin protein HTT, HYPK, HSPBP1 ESR2 3764/4885NR1H2 2756/4885MAPT 8/4885
US-20170283439-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN HTT, HYPK, HSPBP1 ESR2 3764/4885NR1H2 2756/4885MAPT 8/4885

“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.