SCHEMBL25811844

SCHEMBL25811844

CCc1[nH]c2ccc(C(=O)N(I)CCN(C)C)cc2c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 8/20 0.45
TLR8 Q9NR97 8/20 0.45
TLR7 Q9NYK1 8/20 0.45
CYP19A1 P11511 1/20 0.42
HCRTR1 O43613 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
THRB P10828 1/20 0.40
TBXAS1 P24557 1/20 0.39
MAPT P10636 2/20 0.39
HTR1A P08908 1/20 0.39
HTR1D P28221 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR1E P28566 1/20 0.39
HTR7 P34969 1/20 0.39
HTR5A P47898 1/20 0.39
HTR6 P50406 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL25812069 0.89 CYP19A1 (0.44) TLR9TLR8TLR7CYP19A1HCRTR1
SCHEMBL25814985 0.83 TLR9 (0.52) TLR9TLR8TLR7HCRTR1KDM4E
SCHEMBL25811960 0.82 KMT2A (0.47) TLR9TLR8TLR7CYP19A1HCRTR1
SCHEMBL25811280 0.79 ALDH1A1 (0.57) TLR9TLR8TLR7CYP19A1KDM4E
SCHEMBL27734682 0.76 KDM4E (0.67) CYP19A1HCRTR1KDM4EALDH1A1HPGD
SCHEMBL25815032 0.74 KMT2A (0.45) TLR9TLR8TLR7CYP19A1HCRTR1
SCHEMBL25813827 0.74 KDM4E (0.58) TLR9TLR8TLR7HCRTR1KDM4E
SCHEMBL25812014 0.73 KMT2A (0.49) TLR9TLR8TLR7CYP19A1KDM4E
SCHEMBL2161298 0.73 HCRTR1 (0.74) CYP19A1HCRTR1KDM4EALDH1A1HPGD
SCHEMBL25814506 0.73 TLR9 (0.44) TLR9TLR8TLR7HCRTR1KDM4E

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.