SCHEMBL31638306

SCHEMBL31638306

Cc1cnc(Br)cc1OCCCO

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOX P28300 2/20 0.36
▸ AOC3 Q16853 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TUBB1 Q9H4B7 1/20 0.33
▸ LNPEP Q9UIQ6 1/20 0.33
▸ TLR8 Q9NR97 1/20 0.32
▸ IKBKB O14920 1/20 0.32
▸ CYP1A2 P05177 2/20 0.31
▸ TTR P02766 1/20 0.31
▸ CYP2C8 P10632 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ PPARG P37231 1/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ PPARA Q07869 1/20 0.31

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
SCHEMBL31638058 0.91 LOX (0.41) LOXAOC3KDM4ETSHRALDH1A1
SCHEMBL31638036 0.79 LOX (0.36) LOXAOC3TUBB1
SCHEMBL25004559 0.78 HPGD (0.39) AOC3KDM4ETSHRSMN1; SMN2LMNA
SCHEMBL18479255 0.77 LOX (0.38) LOXAOC3KDM4ETUBB1TLR8
SCHEMBL18348256 0.74 NQO2 (0.37) ALDH1A1MAPTL3MBTL1
SCHEMBL31638180 0.72 TUBB1 (0.43) LOXAOC3ALDH1A1TUBB1HTR2B
SCHEMBL31638105 0.72 LMNA (0.47) KDM4ETSHRALDH1A1SMN1; SMN2LMNA
SCHEMBL11796832 0.71 TSHR (0.41) LOXAOC3KDM4ETSHRALDH1A1
SCHEMBL31638100 0.71 HTR7 (0.39) KDM4EALDH1A1SMN1; SMN2LMNACYP1A2
SCHEMBL17336545 0.70 MAPT (0.46) KDM4EMAPTTP53ALOX15

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-2025137541-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2025-06-26 — — WO disclosed
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