SCHEMBL23701284

SCHEMBL23701284

O=C(O)N1CCc2ccc(O)nc2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.36
ESR1 P03372 4/20 0.36
NOTUM Q6P988 1/20 0.36
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
RAB9A P51151 1/20 0.35
PTGS1 P23219 1/20 0.33
RIPK1 Q13546 2/20 0.33
HPGD P15428 2/20 0.33
MAOB P27338 1/20 0.32

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
SCHEMBL4011215 0.89 GRM5 (0.36) ESR2ESR1NOTUMKMT2AMEN1
SCHEMBL8200049 0.85 ABHD6 (0.40) NOTUMKMT2APOLBRECQLTDP1
SCHEMBL27963690 0.83 ABHD6 (0.48) ESR2ESR1NOTUMKMT2APOLB
SCHEMBL22982496 0.80 MAPK1 (0.35) NOTUMKMT2APOLBRECQLTDP1
SCHEMBL25432593 0.79 TAS1R3 (0.35) NOTUMKMT2APOLBRECQLTDP1
SCHEMBL21041656 0.79 ESR2 (0.61) ESR2MAPK1MAPTNPC1RAB9A
SCHEMBL30013710 0.79 ESR2 (0.61) ESR2MAPK1MAPTNPC1RAB9A
SCHEMBL28952612 0.76 ESR2 (0.33) ESR2ESR1NOTUMKMT2AMAPK1
SCHEMBL29860649 0.74 RIPK1 (0.49) NOTUMKMT2AMEN1MAPTTAAR1
SCHEMBL8383914 0.74 RIPK1 (0.49) NOTUMKMT2AMEN1MAPTTAAR1

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 ESR2 3214/4885ESR1 4197/4885NOTUM 4305/4885
US-11992535-B2 Compounds and probes for imaging huntingtin protein HTT, HYPK, HSPBP1 ESR2 3214/4885ESR1 4197/4885NOTUM 4305/4885

“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.