SCHEMBL29939674

SCHEMBL29939674

C=Cc1ccc(O)c(Cn2nc3ccccc3n2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.37
▸ BACE1 P56817 1/20 0.37
▸ GABRA1 P14867 1/20 0.36
▸ GABRB2 P47870 1/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ LMNA P02545 3/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ HPGD P15428 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 2/20 0.33

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
SCHEMBL11466945 0.77 LMNA (0.55) MEN1KMT2AMAPK1USP2LMNA
SCHEMBL27501139 0.76 KCNMA1 (0.53) MEN1KMT2AMAPK1LMNANPC1
SCHEMBL251422 0.75 NPC1 (0.61) TRPA1MEN1KMT2ALMNANPC1
SCHEMBL10292364 0.73 LMNA (0.53) TRPA1BACE1MEN1KMT2ALMNA
SCHEMBL13899836 0.71 TRPA1 (0.50) TRPA1GABRA1GABRB2MEN1KMT2A
SCHEMBL5855849 0.71 HSPA5 (0.57) TRPA1GABRA1GABRB2MEN1KMT2A
SCHEMBL9868391 0.71 NPC1 (0.47) TRPA1MEN1KMT2AUSP2LMNA
SCHEMBL9307175 0.70 MEN1 (0.57) TRPA1MEN1KMT2AHPGDALOX15
SCHEMBL29072079 0.70 ALOX5 (0.47) BACE1USP2HPGDALDH1A1MAPT
SCHEMBL685704 0.70 TRPA1 (0.48) TRPA1GABRA1GABRB2POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115216854-B Environment-friendly antibacterial ganoderma lucidum fiber and preparation method thereof 李庆生 2023-08-15 — — CN claimed
CN-115216854-A Environment-friendly antibacterial ganoderma lucidum fiber and preparation method thereof 李庆生 2022-10-21 — — CN claimed
CN-115216854-B Environment-friendly antibacterial ganoderma lucidum fiber and preparation method thereof 李庆生 2023-08-15 — — CN disclosed
CN-115216854-A Environment-friendly antibacterial ganoderma lucidum fiber and preparation method thereof 李庆生 2022-10-21 — — CN disclosed
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