SCHEMBL25813769

SCHEMBL25813769

CCc1c(C)n(I)c2ccc(C(=O)NCCN(C)C)cc12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 3/20 0.48
TLR8 Q9NR97 3/20 0.48
TLR7 Q9NYK1 3/20 0.48
ALDH1A1 P00352 2/20 0.46
USP2 O75604 1/20 0.45
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NAMPT P43490 1/20 0.43
MAPT P10636 5/20 0.43
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TOP2A P11388 1/20 0.42
PTGER4 P35408 1/20 0.42
ACSS2 Q9NR19 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL25813246 0.90 LMNA (0.50) ALDH1A1HTTSMN1; SMN2NAMPTKDM4E
SCHEMBL25811758 0.80 RAD52 (0.59) TLR9TLR8TLR7NAMPTMAPT
SCHEMBL25811770 0.80 KMT2A (0.66) TLR9TLR8TLR7ALDH1A1MAPT
SCHEMBL25811293 0.77 MAPT (0.65) ALDH1A1MAPTKDM4EHPGDHSD17B10
SCHEMBL30312302 0.77 MAPT (0.65) ALDH1A1MAPTKDM4EHPGDHSD17B10
SCHEMBL25811207 0.75 TLR8 (0.64) TLR9TLR8TLR7ALDH1A1HTT
SCHEMBL25813788 0.75 MAPT (0.48) ALDH1A1HTTSMN1; SMN2NAMPTMAPT
SCHEMBL30046741 0.72 ALDH1A1 (0.73) ALDH1A1USP2HTTSMN1; SMN2NAMPT
SCHEMBL14435527 0.71 SMN1; SMN2 (0.61) ALDH1A1USP2HTTSMN1; SMN2MAPT
SCHEMBL2161339 0.71 THRB (0.71) ALDH1A1MAPTKMT2AMEN1

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 TLR9 4628/4885TLR8 4582/4885TLR7 4556/4885

“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.