SCHEMBL29660216

SCHEMBL29660216

COc1ccc2c(c1)sc1nc(C(=O)Nc3ccncc3)cn12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.57
LMNA P02545 2/20 0.57
MAPT P10636 5/20 0.57
APP P05067 1/20 0.53
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
ESR1 P03372 1/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
KMT2A Q03164 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TYK2 P29597 2/20 0.51
TP53 P04637 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
JAK2 O60674 1/20 0.51
TSHR P16473 1/20 0.51
RAB9A P51151 1/20 0.51
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL18548689 1.00 RXFP1 (0.57) RXFP1LMNAMAPTAPPKDM4E
SCHEMBL18548672 0.88 LMNA (0.54) RXFP1LMNAMAPTAPPKDM4E
SCHEMBL29660220 0.88 LMNA (0.54) RXFP1LMNAMAPTAPPKDM4E
SCHEMBL29660131 0.88 RAB9A (0.52) RXFP1LMNAMAPTAPPKDM4E
SCHEMBL29660319 0.88 RAB9A (0.52) RXFP1LMNAMAPTAPPKDM4E
SCHEMBL18548642 0.88 RAB9A (0.52) RXFP1LMNAMAPTAPPKDM4E
SCHEMBL29660162 0.88 LMNA (0.53) RXFP1LMNAMAPTAPPTP53
SCHEMBL18548611 0.88 LMNA (0.53) RXFP1LMNAMAPTAPPTP53
SCHEMBL23053053 0.87 LMNA (0.62) RXFP1LMNAMAPTAPPMEN1
SCHEMBL18548640 0.85 LMNA (0.53) RXFP1LMNAMAPTAPPKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12083108-B2 Compounds for targeting mutant huntingtin protein and uses thereof CHDI FOUNDATION, INC. (US) 2024-09-10 US disclosed
US-20220409600-A1 COMPOUNDS FOR TARGETING MUTANT HUNTINGTIN PROTEIN AND USES THEREOF CHDI FOUNDATION, INC. 2022-12-29 US disclosed
US-11389438-B2 Compounds for targeting mutant huntingtin protein and uses thereof CHDI FOUNDATION, INC. (US) 2022-07-19 US disclosed
US-11344637-B2 Probes for imaging huntingtin protein CHDI FOUNDATION, INC. (US) 2022-05-31 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 (4 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-11344637-B2 Probes for imaging huntingtin protein HTT, HYPK, HSPBP1 RXFP1 660/4885LMNA 2021/4885MAPT 8/4885
US-12083108-B2 Compounds for targeting mutant huntingtin protein and uses thereof HTT, HYPK, UBQLN2 RXFP1 4566/4885LMNA 3285/4885MAPT 12/4885
US-11389438-B2 Compounds for targeting mutant huntingtin protein and uses thereof HTT, HYPK, UBQLN2 RXFP1 4566/4885LMNA 3285/4885MAPT 12/4885
US-20220409600-A1 COMPOUNDS FOR TARGETING MUTANT HUNTINGTIN PROTEIN AND USES THEREOF HTT, HYPK, UBQLN2 RXFP1 4566/4885LMNA 3285/4885MAPT 12/4885

“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.