SCHEMBL30958792

SCHEMBL30958792

O=Cc1ccccc1C=Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
THRB P10828 1/20 0.62
BLM P54132 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
NFE2L2 Q16236 4/20 0.56
TRPA1 O75762 3/20 0.56
ALDH1A1 P00352 4/20 0.52
CYP2A6 P11509 1/20 0.52
ALOX5 P09917 1/20 0.50
MAPK1 P28482 1/20 0.50
MAOB P27338 2/20 0.46
CYP19A1 P11511 1/20 0.44
MAOA P21397 1/20 0.44
TSHR P16473 1/20 0.44
TRIM24 O15164 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
DPYD Q12882 1/20 0.44
HDAC3 O15379 1/20 0.43

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
SCHEMBL192399 1.00 LMNA (0.62) LMNAMEN1KMT2ATHRBBLM
SCHEMBL192400 1.00 LMNA (0.62) LMNAMEN1KMT2ATHRBBLM
SCHEMBL24385991 1.00 LMNA (0.62) LMNAMEN1KMT2ATHRBBLM
(Z)-1,2-Diphenylethene SCHEMBL7653143 0.87 NFE2L2 (0.68) MEN1KMT2ANFE2L2TRPA1MAOB
SCHEMBL44502 0.87 NFE2L2 (0.68) MEN1KMT2ANFE2L2TRPA1MAOB
SCHEMBL6360540 0.87 NFE2L2 (0.68) MEN1KMT2ANFE2L2TRPA1MAOB
SCHEMBL44503 0.87 NFE2L2 (0.68) MEN1KMT2ANFE2L2TRPA1MAOB
(Z)-1,2-Diphenylethene SCHEMBL7653150 0.87 NFE2L2 (0.68) MEN1KMT2ANFE2L2TRPA1MAOB
SCHEMBL9540538 0.87 NFE2L2 (0.68) MEN1KMT2ANFE2L2TRPA1MAOB
SCHEMBL5411617 0.87 NFE2L2 (0.68) MEN1KMT2ANFE2L2TRPA1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117903135-A Method for preparing fullerene pyrrolidine tetrahydroisoquinoline based on participation of o-styryl benzaldehyde 湖北大学 2024-04-19 CN claimed
CN-118561840-A Synthesis method of dihydroimidazo [2,1-a ] isoquinoline derivatives 海南医学院 2024-08-30 CN disclosed
CN-117903135-A Method for preparing fullerene pyrrolidine tetrahydroisoquinoline based on participation of o-styryl benzaldehyde 湖北大学 2024-04-19 CN disclosed
CN-117903135-A Method for preparing fullerene pyrrolidine tetrahydroisoquinoline based on participation of o-styryl benzaldehyde 湖北大学 2024-04-19 CN disclosed
CN-117903135-A Method for preparing fullerene pyrrolidine tetrahydroisoquinoline based on participation of o-styryl benzaldehyde 湖北大学 2024-04-19 CN disclosed