Lyral

Lyral

SCHEMBL6693247

CC(C)(O)CCCC1=CCC(C=O)CC1.CC(C)=CCCC1=CCC(C=O)CC1.CC1=CC(C)C(C=O)CC1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ STAT3 P40763 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CHRNA7 P36544 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PTPN1 P18031 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ FNTA P49354 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ PGGT1B P53609 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ BCL2L1 Q07817 2/20 0.30
▸ MCL1 Q07820 2/20 0.30
▸ FNTB P49356 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
Lyral SCHEMBL5986927 0.87 MEN1 (0.44) MEN1KMT2ACYP3A4ALOX15STAT3
Lyral SCHEMBL26622234 0.81 ALDH1A1 (0.39) MEN1KMT2ACYP3A4ALOX15STAT3
Lyral SCHEMBL30754376 0.79 CES2 (0.39) MEN1KMT2ACYP3A4ALOX15STAT3
Lyral SCHEMBL20605413 0.79 CES2 (0.39) MEN1KMT2ACYP3A4ALOX15STAT3
Lyral SCHEMBL112060 0.79 CES2 (0.39) MEN1KMT2ACYP3A4ALOX15STAT3
Lyral SCHEMBL28150914 0.78 CES2 (0.38) MEN1KMT2AALDH1A1MAPT
SCHEMBL214415 0.76 ALDH1A1 (0.53) MEN1KMT2ACYP3A4ALOX15STAT3
SCHEMBL29626008 0.76 ALDH1A1 (0.53) MEN1KMT2ACYP3A4ALOX15STAT3
SCHEMBL19717960 0.76 ALDH1A1 (0.53) MEN1KMT2ACYP3A4ALOX15STAT3
SCHEMBL5019006 0.71 CES2 (0.41) MEN1KMT2ACYP3A4ALOX15STAT3

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
WO-2004052330-A1 SKIN LIGHTENING DERIVATIVES OF DI-THIANE RESORCINOL, COMPOSITIONS AND METHODS UNILEVER PLC (GB) 2004-06-24 — — WO disclosed
WO-2004052329-A1 DI-SUBSTITUTED RESORCINOLS AS SKIN LIGHTENING AGENTS UNILEVER PLC (GB) 2004-06-24 — — WO disclosed
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