SCHEMBL28876206

SCHEMBL28876206

C=CCc1cc2ccccc2[nH]1.C=CCc1cc2ccccc2[nH]1.[MgH2]

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.56
▸ IDO1 P14902 3/20 0.50
▸ MTNR1A P48039 1/20 0.46
▸ MTNR1B P49286 1/20 0.46
▸ HRH3 Q9Y5N1 1/20 0.45
▸ AHR P35869 1/20 0.45
▸ HRH4 Q9H3N8 1/20 0.44
▸ CYP2A6 P11509 1/20 0.43
▸ AOC3 Q16853 2/20 0.42
▸ PCSK9 Q8NBP7 1/20 0.41

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
SCHEMBL28876221 1.00 LOXL2 (0.56) LOXL2IDO1MTNR1AMTNR1BHRH3
SCHEMBL31105584 0.98 LOXL2 (0.58) LOXL2IDO1MTNR1AMTNR1BHRH3
SCHEMBL325463 0.98 LOXL2 (0.58) LOXL2IDO1MTNR1AMTNR1BHRH3
Ammonia Solution, Strong SCHEMBL28873731 0.96 LOXL2 (0.56) LOXL2IDO1MTNR1AMTNR1BHRH3
Bromide SCHEMBL27641073 0.96 LOXL2 (0.56) LOXL2IDO1MTNR1AMTNR1BHRH3
SCHEMBL28346906 0.85 LOXL2 (0.45) LOXL2IDO1MTNR1AMTNR1BHRH3
SCHEMBL5642064 0.81 LOXL2 (0.60) LOXL2IDO1MTNR1AMTNR1BHRH3
SCHEMBL2592547 0.81 LOXL2 (0.60) LOXL2IDO1MTNR1AMTNR1BHRH3
SCHEMBL6254747 0.80 LOXL2 (0.55) LOXL2IDO1MTNR1AMTNR1BHRH3
SCHEMBL6156791 0.80 LOXL2 (0.55) LOXL2IDO1MTNR1AMTNR1BHRH3

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
CN-115108532-B Magnesium-based hydrogen storage material and preparation method thereof 苏州清德氢能源科技有限公司 2022-11-15 — — CN disclosed
CN-115108532-A Magnesium-based hydrogen storage material and preparation method thereof 苏州清德氢能源科技有限公司 2022-09-27 — — CN disclosed
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