SCHEMBL25812220

SCHEMBL25812220

Cc1[nH]c2ccc(C(=N)NCCN3CCOCC3)cc2c1C

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KMT2A Q03164 2/20 0.53
PARP1 P09874 4/20 0.48
POLB P06746 1/20 0.47
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GFER P55789 1/20 0.44
JAK2 O60674 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL25811886 0.89 KMT2A (0.67) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25811210 0.87 KMT2A (0.70) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25811246 0.76 KMT2A (0.82) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25811263 0.76 KMT2A (0.85) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL30312303 0.76 KMT2A (0.82) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25811268 0.76 KMT2A (0.62) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25811270 0.76 POLB (0.61) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25811307 0.76 KMT2A (0.88) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25811497 0.76 KMT2A (0.73) ALDH1A1KDM4EL3MBTL1KMT2APARP1
SCHEMBL25814483 0.75 ALDH1A1 (0.53) ALDH1A1KDM4EL3MBTL1KMT2APARP1

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 ALDH1A1 4430/4885KDM4E 1465/4885L3MBTL1 236/4885

“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.