SCHEMBL25811758

SCHEMBL25811758

CCc1c(C)n(I)c2ccc(C(=O)NCCN3CCN(C)CC3)cc12

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.59
KMT2A Q03164 3/20 0.55
HDAC2 Q92769 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.48
TLR9 Q9NR96 3/20 0.47
TLR7 Q9NYK1 3/20 0.47
TLR8 Q9NR97 2/20 0.47
POLB P06746 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
NAMPT P43490 1/20 0.45

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
SCHEMBL25811770 0.92 KMT2A (0.66) RAD52KMT2AMEN1MAPTTLR9
SCHEMBL25812546 0.90 RAD52 (0.69) RAD52KMT2AHDAC2HDAC8HDAC6
SCHEMBL25811723 0.85 RAD52 (0.61) RAD52KMT2AHDAC2HDAC8HDAC6
SCHEMBL25811765 0.80 KMT2A (0.71) RAD52KMT2AMEN1MAPTPOLB
SCHEMBL25813769 0.80 TLR9 (0.48) KMT2AMEN1MAPTTLR9TLR7
SCHEMBL25811305 0.80 RAD52 (0.87) RAD52KMT2AHDAC2HDAC8HDAC6
SCHEMBL25813246 0.79 LMNA (0.50) KMT2AMEN1POLBNAMPT
SCHEMBL25811242 0.79 TLR9 (0.60) RAD52KMT2AHDAC2HDAC8HDAC6
SCHEMBL25812228 0.77 KMT2A (0.64) RAD52KMT2AMEN1MAPTPOLB
SCHEMBL25811739 0.77 KMT2A (0.67) RAD52KMT2AMEN1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230218573-A1 INDOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES GALYAN BIO INC (US) 2023-07-13 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 (1 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-20230218573-A1 INDOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES HTT, HYPK, PARK7 RAD52 1790/4885KMT2A 981/4885HDAC2 780/4885

“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.