SCHEMBL25848023

SCHEMBL25848023

Fc1cc[n+](Cc2ccccc2)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.47
▸ ACHE P22303 5/20 0.44
▸ CHKA P35790 5/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ HTT P42858 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ BCHE P06276 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ DRD4 P21917 1/20 0.38
▸ DRD3 P35462 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
SCHEMBL15836459 0.79 ALDH1A1 (0.49) LMNAACHECHKAALDH1A1HTT
SCHEMBL31652036 0.77 ACHE (0.48) LMNAACHECHKAALDH1A1HTT
Bromide SCHEMBL15821503 0.77 ACHE (0.50) LMNAACHECHKAALDH1A1HTT
Bromide SCHEMBL23858158 0.74 CHKA (0.49) LMNAACHECHKAALDH1A1HTT
SCHEMBL10692064 0.72 CHKA (0.57) LMNAACHECHKAALDH1A1HTT
SCHEMBL14211654 0.72 ACHE (0.45) LMNAACHECHKAALDH1A1HTT
SCHEMBL13089694 0.71 ACHE (0.53) LMNAACHECHKAALDH1A1HTT
Bromide SCHEMBL17632298 0.71 ACHE (0.48) LMNAACHECHKAALDH1A1HTT
Bromide SCHEMBL9691766 0.71 CHKA (0.58) LMNAACHECHKAALDH1A1HTT
SCHEMBL1127774 0.69 ACHE (0.85) ACHEBCHE

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-2023133543-A1 RAS INHIBITORS Revolution Medicines, Inc. (US) 2023-07-13 — — WO disclosed
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