SCHEMBL30679188

SCHEMBL30679188

c1ccc(-n2c3ccccc3c3ccc(-c4cncc5ccccc45)cc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PRKCZ Q05513 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ CYP11B1 P15538 15/20 0.48
▸ CYP11B2 P19099 15/20 0.48
▸ CYP2D6 P10635 2/20 0.48
▸ CYP2C9 P11712 2/20 0.48
▸ CYP2B6 P20813 2/20 0.48
▸ CYP2C19 P33261 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ ERN1 O75460 1/20 0.45
▸ PRMT5 O14744 1/20 0.43
▸ WDR77 Q9BQA1 1/20 0.43
▸ NTSR1 P30989 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
SCHEMBL15073528 0.88 PRKCZ (0.49) PRKCZKDM4EATML3MBTL1CYP11B1
SCHEMBL15073489 0.88 PRKCZ (0.49) PRKCZKDM4EATML3MBTL1CYP11B1
SCHEMBL15073796 0.85 PRKCZ (0.51) PRKCZKDM4EATML3MBTL1CYP11B1
SCHEMBL17349326 0.85 L3MBTL1 (0.50) KDM4EATML3MBTL1CYP11B1CYP11B2
SCHEMBL15073758 0.84 PRKCZ (0.42) PRKCZKDM4EATML3MBTL1CYP11B1
SCHEMBL15073502 0.84 PRKCZ (0.42) PRKCZKDM4EATML3MBTL1CYP11B1
SCHEMBL15073522 0.84 PRKCZ (0.42) PRKCZKDM4EATML3MBTL1CYP11B1
SCHEMBL15073701 0.84 PRKCZ (0.42) PRKCZKDM4EATML3MBTL1CYP11B1
SCHEMBL17348919 0.84 L3MBTL1 (0.49) KDM4EATML3MBTL1CYP11B1CYP11B2
SCHEMBL15073781 0.83 PRKCZ (0.49) PRKCZKDM4EATML3MBTL1CYP11B1

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-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 claimed
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 claimed
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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