SCHEMBL30679192

SCHEMBL30679192

CCOc1ncc(-c2cccc3c4ccccc4n(-c4ccccc4)c23)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ MAPK8 P45983 1/20 0.36
▸ MAPT P10636 4/20 0.36
▸ HPGD P15428 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ DUSP3 P51452 1/20 0.36
▸ MAT2A P31153 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ LMNA P02545 3/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ NPY1R P25929 1/20 0.35
▸ NPY2R P49146 1/20 0.35
▸ CYP17A1 P05093 1/20 0.35

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
SCHEMBL29150862 0.82 ALDH1A1 (0.38) L3MBTL1KDM4EATMMAPTHPGD
SCHEMBL29150812 0.81 L3MBTL1 (0.43) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL20706844 0.79 L3MBTL1 (0.65) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL30017427 0.79 L3MBTL1 (0.65) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL14296105 0.78 L3MBTL1 (0.63) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL14296009 0.78 L3MBTL1 (0.63) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL21382459 0.78 L3MBTL1 (0.63) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL14296084 0.78 L3MBTL1 (0.63) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL30679195 0.78 KDM4E (0.47) L3MBTL1KDM4EATMMAPK8MAPT
SCHEMBL16675303 0.75 KDM4E (0.59) L3MBTL1KDM4EATMMAPK8MAPT

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-117143017-B Method for constructing isoquinoline compound based on aryl migration strategy, hole transport material molecule and preparation method thereof, perovskite solar cell and preparation method thereof 广东工业大学 2026-05-19 — — CN disclosed
CN-117143017-A Method for constructing isoquinoline compound based on aryl migration strategy, hole transport material molecule and preparation method thereof, perovskite solar cell and preparation method thereof 广东工业大学 2023-12-01 — — CN disclosed
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