SCHEMBL28124792

SCHEMBL28124792

CCON1CCN(c2ccc(C=O)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.60
▸ TRIM24 O15164 1/20 0.56
▸ TRIM33 Q9UPN9 1/20 0.56
▸ KDM4E B2RXH2 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ MAOB P27338 1/20 0.43
▸ MAPT P10636 6/20 0.41
▸ LMNA P02545 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SENP8 Q96LD8 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL3077544 0.80 TRIM24 (0.83) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL2561698 0.80 TRIM24 (0.83) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL5356967 0.78 ALDH1A1 (0.66) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL740054 0.78 CHRNA7 (0.58) ALDH1A1KDM4ESMN1; SMN2MAPTLMNA
SCHEMBL10366199 0.77 MAPT (0.71) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL23086408 0.76 ALDH1A1 (0.58) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL23922764 0.76 ALDH1A1 (0.58) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL208547 0.75 ALDH1A1 (1.00) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL21292774 0.75 ALDH1A1 (0.62) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL17149208 0.75 HSD11B1 (0.45) ALDH1A1KDM4EMAPTLMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104693199-B 2,9-bis-styryl substituted phenanthroline compounds, and preparation method and application thereof 中国科学院化学研究所 2017-01-25 — — CN disclosed
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