SCHEMBL28287512

SCHEMBL28287512

Nc1ccc2c(c1N)C(=O)c1c(N)c(N)c(N)c(N)c1C2=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.68
▸ MAOB P27338 1/20 0.68
▸ MEN1 O00255 8/20 0.52
▸ KMT2A Q03164 8/20 0.52
▸ THRB P10828 7/20 0.52
▸ ALDH1A1 P00352 7/20 0.52
▸ MAPT P10636 7/20 0.52
▸ POLB P06746 6/20 0.52
▸ L3MBTL1 Q9Y468 4/20 0.52
▸ TDP1 Q9NUW8 4/20 0.52
▸ MCL1 Q07820 4/20 0.52
▸ RAB9A P51151 3/20 0.52
▸ RECQL P46063 3/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ BLM P54132 2/20 0.52
▸ APEX1 P27695 2/20 0.52
▸ ADORA2A P29274 5/20 0.45
▸ CSNK1A1 P48729 2/20 0.45
▸ CSNK1D P48730 2/20 0.45
▸ CSNK1G1 Q9HCP0 2/20 0.45

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
SCHEMBL12124164 0.91 MAOA (0.79) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL10805076 0.82 MAOA (0.61) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL9358000 0.81 MAOA (0.56) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL11680862 0.81 MAOA (0.71) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL30129869 0.81 MAOA (1.00) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL487001 0.81 MAOA (1.00) MAOAMAOBMEN1KMT2ATHRB
Ammonia Solution, Strong SCHEMBL6046897 0.79 MAOA (0.96) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL3740221 0.77 MAOA (0.85) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL31177128 0.77 MAOA (0.85) MAOAMAOBMEN1KMT2ATHRB
SCHEMBL28827042 0.75 MAOA (0.86) MAOAMAOBMEN1KMT2ATHRB

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-109554004-A Pigment dispersing agent and application thereof 江苏丽王科技股份有限公司 2019-04-02 — — CN claimed
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