SCHEMBL30968555

SCHEMBL30968555

CC(C)(C)OC(=O)N1C2CCC1(c1ccc3c(c1)OCC(N)C3)CNC2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.31
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
LTB4R Q15722 1/20 0.30
LTB4R2 Q9NPC1 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL30968447 0.85
SCHEMBL30968419 0.84 OPRK1 (0.36) KDM1ADDB1CRBN
SCHEMBL31634911 0.77 RORC (0.41)
SCHEMBL30669805 0.74 GPR119 (0.37)
SCHEMBL30968553 0.74 ACHE (0.33) KDM1ADDB1CRBN
SCHEMBL30060095 0.74 GPR183 (0.38) KDM1A
SCHEMBL20731532 0.74 GPR183 (0.38) KDM1A
SCHEMBL30968544 0.74 RORC (0.33) DDB1CRBN
SCHEMBL30968418 0.73
SCHEMBL30741098 0.71 PSEN1 (0.39) KDM1ADDB1CRBNHRH3

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
CN-112867712-B Carboxamide as ubiquitin-specific protease inhibitor 瓦洛早期发现股份有限公司 2024-07-16 CN disclosed