SCHEMBL28124980

SCHEMBL28124980

O=c1cc(-c2c[nH]c3ccccc23)c2ccccc2o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.61
▸ MAOA P21397 2/20 0.51
▸ PRKCB P05771 3/20 0.49
▸ SIRT2 Q8IXJ6 2/20 0.49
▸ PRKCA P17252 2/20 0.49
▸ PRKD3 O94806 1/20 0.49
▸ CCNB2 O95067 1/20 0.49
▸ CCNE2 O96020 1/20 0.49
▸ ABL1 P00519 1/20 0.49
▸ PRKCG P05129 1/20 0.49
▸ CDK1 P06493 1/20 0.49
▸ PIM1 P11309 1/20 0.49
▸ CDK4 P11802 1/20 0.49
▸ CCNB1 P14635 1/20 0.49
▸ PRKACA P17612 1/20 0.49
▸ PRKACG P22612 1/20 0.49
▸ PRKACB P22694 1/20 0.49
▸ CCND1 P24385 1/20 0.49
▸ PRKCH P24723 1/20 0.49
▸ CCNE1 P24864 1/20 0.49

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
SCHEMBL28124984 0.86 MAOB (0.50) MAOBMAOAPRKCBSIRT2PRKCA
SCHEMBL5396825 0.83 NQO1 (0.67) MAOBMAOANQO1CA12CA1
SCHEMBL8787802 0.77 HPGD (0.57) MAOBCA12CA1CA9MAPK1
SCHEMBL1202543 0.75 IMPDH2 (0.63) MAOBPRKCBSIRT2PRKCAPRKD3
SCHEMBL8788046 0.73 MAOB (0.55) MAOBMAOAPRKCBSIRT2PRKCA
SCHEMBL31264770 0.73 CA9 (0.68) MAOBMAOANQO1CA12CA1
SCHEMBL516275 0.73 CA9 (0.68) MAOBMAOANQO1CA12CA1
SCHEMBL28124981 0.73 KDR (0.54) MAOBNQO1CA12CA1CA9
SCHEMBL5398907 0.72 NQO1 (0.53) MAOBMAOANQO1CA12CA1
SCHEMBL30228412 0.72 KCNA3 (0.62) MAOANQO1CA12CA1CA9

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-106317030-A 4-indolyl coumarin derivative, and preparing method and application thereof 国家烟草质量监督检验中心 2017-01-11 — — CN disclosed
CN-106317030-A 4-indolyl coumarin derivative, and preparing method and application thereof 国家烟草质量监督检验中心 2017-01-11 — — CN disclosed
Send feedback