SCHEMBL30935682

SCHEMBL30935682

CCC(O)CC(=O)n1ccnc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 1/20 0.33
TBXAS1 P24557 4/20 0.33
EGLN3 Q9H6Z9 1/20 0.33
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
AHR P35869 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HMOX2 P30519 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP17A1 P05093 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
SCHEMBL17004057 0.83 MAPT (0.46) FAAHMGLLALDH1A1RAB9ALMNA
SCHEMBL4211623 0.83 TBXAS1 (0.35) FAAHMGLLALDH1A1LMNATBXAS1
SCHEMBL15730995 0.83 TBXAS1 (0.35) FAAHMGLLALDH1A1LMNATBXAS1
SCHEMBL4211619 0.83 TBXAS1 (0.35) FAAHMGLLALDH1A1LMNATBXAS1
SCHEMBL25635684 0.80 TBXAS1 (0.37) FAAHMGLLALDH1A1TBXAS1EGLN3
SCHEMBL30935536 0.79 KDM4E (0.38) FAAHMGLLALDH1A1RAB9ATBXAS1
SCHEMBL25507659 0.79 TBXAS1 (0.36) FAAHMGLLALDH1A1RAB9ATBXAS1
SCHEMBL5217912 0.77
SCHEMBL22047552 0.77 TBXAS1 (0.46) FAAHMGLLALDH1A1TBXAS1EGLN3
SCHEMBL4199017 0.77 TBXAS1 (0.36) ALDH1A1LMNATBXAS1EGLN3AHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4630424-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT KINASE INHIBITORS Third Harmonic Bio, Inc. (US) 2025-10-15 EP disclosed
WO-2024124002-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT KINASE INHIBITORS THIRD HARMONIC BIO, INC. (US) 2024-06-13 WO disclosed