SCHEMBL9049308

SCHEMBL9049308

Brc1ccc2c(c1)OCCC21OCCO1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
BLM P54132 1/20 0.44
MAP3K14 Q99558 3/20 0.36
AHR P35869 3/20 0.35
BACE1 P56817 3/20 0.33
HTR2C P28335 1/20 0.32
PKM P14618 1/20 0.31
ADRA2A P08913 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAOB P27338 1/20 0.31
APP P05067 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
SCHEMBL19889341 0.79 LMNA (0.47) LMNAMAPTHTTBLMMAP3K14
SCHEMBL4847627 0.77 LMNA (0.46) LMNAMAPTHTTBLMMAP3K14
SCHEMBL30250112 0.77 LMNA (0.46) LMNAMAPTHTTBLMMAP3K14
SCHEMBL19889348 0.77 LMNA (0.46) LMNAMAPTHTTBLMMAP3K14
SCHEMBL17495177 0.77 BACE1 (0.45) LMNAMAPTHTTBLMAHR
SCHEMBL9050393 0.76 ALDH1A1 (0.45) MAPTMAP3K14
SCHEMBL9049281 0.76 MAP3K14 (0.38) MAP3K14SMN1; SMN2
SCHEMBL23362642 0.75 MAP3K14 (0.43) LMNAMAPTHTTBLMMAP3K14
SCHEMBL23362552 0.75 MAPT (0.43) LMNAMAPTHTTBLMMAP3K14
SCHEMBL4817625 0.74 KDM1A (0.40) AHRBACE1PKMADRA2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024254599-A1 HPGD INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. (US) 2024-12-12 WO disclosed
EP-0555068-B1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1996-04-10 EP disclosed
US-5482966-A LIPOXYGENASE ENZYME INHIBITORS AS ANTIINFLAMMATORY AGENTS ZENECA LIMITED (GB) 1996-01-09 US disclosed
US-5332757-A Enzyme inhibitors ZENECA LIMITED (GB) 1994-07-26 US disclosed
EP-0581464-A1 Ester derivatives and pharmaceutical compositions containing them ZENECA LIMITED (GB) 1994-02-02 EP disclosed
EP-0555068-A1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP disclosed