SCHEMBL27429484

SCHEMBL27429484

COc1ccc(Nc2nc(N3CCN(C)CC3)nc3nccnc23)cc1Cl

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BCL6 P41182 5/20 0.66
▸ BRD4 O60885 7/20 0.50
▸ HRH4 Q9H3N8 1/20 0.48
▸ MAPT P10636 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ EGFR P00533 1/20 0.47
▸ ERBB2 P04626 1/20 0.47
▸ NCOR2 Q9Y618 1/20 0.46
▸ GRM4 Q14833 1/20 0.46
▸ EPHA2 P29317 1/20 0.46
▸ EPHB4 P54760 1/20 0.46
▸ TNIK Q9UKE5 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
SCHEMBL27248392 0.88 HPGD (0.50) BCL6BRD4HRH4MAPTGRM4
SCHEMBL27430032 0.83 HTR2C (0.60) HRH4
SCHEMBL27248311 0.82 HPGD (0.58) BCL6HRH4MAPT
SCHEMBL27429710 0.82 HTR2C (0.64) BRD4HRH4GRM4
SCHEMBL27248319 0.81 HRH4 (0.46) BCL6BRD4HRH4LMNA
SCHEMBL27430034 0.80 HTR2C (0.48) HRH4LMNA
SCHEMBL23867520 0.79 TDP1 (0.48) BCL6MAPTGRM4
SCHEMBL27429988 0.79 HTR2C (0.61) HRH4
SCHEMBL27248325 0.78 HPGD (0.54) BCL6HRH4MAPT
SCHEMBL27248330 0.78 L3MBTL1 (0.58) HRH4MAPTLMNAEGFR

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
WO-2024118607-A1 COMPOUNDS, COMPOSITIONS, AND METHODS CHDI FOUNDATION, INC. (US) 2024-06-06 — — WO disclosed
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