SCHEMBL34461930

SCHEMBL34461930

c1ccc2c(-c3cc(-c4cnccn4)nc(-c4cnccn4)c3)c3ccccc3cc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.43
▸ PIM1 P11309 3/20 0.43
▸ CYP11B1 P15538 1/20 0.41
▸ CYP19A1 P11511 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ METAP2 P50579 1/20 0.38
▸ CCR1 P32246 1/20 0.38
▸ CCR5 P51681 1/20 0.38
▸ CCR8 P51685 1/20 0.38
▸ GPR84 Q9NQS5 1/20 0.37
▸ NISCH Q9Y2I1 1/20 0.37
▸ ALOX5AP P20292 1/20 0.36
▸ FEN1 P39748 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ RAD52 P43351 1/20 0.35
▸ PIK3CD O00329 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
SCHEMBL17755609 0.82 CYP19A1 (0.51) CYP3A4PIM1CYP11B1CYP19A1METAP2
SCHEMBL31147813 0.81 CCR1 (0.56) ALOX5CCR1CCR5CCR8ADORA3
SCHEMBL17755608 0.78 CYP19A1 (0.62) CYP3A4PIM1CYP19A1METAP2CCR1
SCHEMBL29482241 0.78 CYP19A1 (0.62) CYP3A4PIM1CYP19A1METAP2CCR1
SCHEMBL32677335 0.77 CYP2A6 (0.55) CYP3A4PIM1CYP19A1METAP2CCR1
SCHEMBL8272308 0.76 CYP3A4 (0.47) CYP3A4PIM1CYP11B1METAP2ADORA3
SCHEMBL18334161 0.76 CYP19A1 (0.44) CYP3A4PIM1CYP19A1METAP2ALOX5AP
SCHEMBL22215402 0.75 TDO2 (0.52) CYP3A4PIM1CYP11B1CYP19A1ALOX5
SCHEMBL22215485 0.75 TDO2 (0.52) CYP11B1CYP19A1ALOX5KDM4EPOLB
SCHEMBL2812920 0.73 CYP11B1 (0.66) CYP3A4CYP11B1CYP19A1ALOX5GPR84

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-121851067-A Near infrared luminescent ruthenium (II) complex, preparation method thereof and application thereof as DNA intercalator 广西民族师范学院 2026-04-14 — — CN disclosed
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