SCHEMBL29405578

SCHEMBL29405578

Cc1c2c(nn1S(=O)(=O)c1ccc(C#N)cc1)-c1ccccc1C(=O)C2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.41
▸ IDO1 P14902 2/20 0.40
▸ TDO2 P48775 1/20 0.40
▸ CTSG P08311 1/20 0.39
▸ CMA1 P23946 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PSEN1 P49768 1/20 0.37
▸ PSEN2 P49810 1/20 0.37
▸ APH1B Q8WW43 1/20 0.37
▸ NCSTN Q92542 1/20 0.37
▸ APH1A Q96BI3 1/20 0.37

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
SCHEMBL25258633 1.00 MAOB (0.41) MAOBIDO1TDO2CTSGCMA1
SCHEMBL25253327 0.87 NR1H2 (0.45) ALDH1A1MEN1LMNAKMT2ATDP1
SCHEMBL29405655 0.87 NR1H2 (0.45) ALDH1A1MEN1LMNAKMT2ATDP1
SCHEMBL29404553 0.87 KMT2A (0.42) MAOBALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25259052 0.87 KMT2A (0.42) MAOBALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25257867 0.85 MEN1 (0.47) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL29402620 0.85 MEN1 (0.47) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL25259709 0.85 TP53 (0.44) MAOBALDH1A1MEN1LMNAKMT2A
SCHEMBL29405020 0.85 TP53 (0.44) MAOBALDH1A1MEN1LMNAKMT2A
SCHEMBL25256191 0.83 KMT2A (0.46) MAOBALDH1A1MEN1LMNAKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115956071-A Imidazoquinoline or benzindazolone compounds and intermediates for their preparation LMITO药业株式会社 2023-04-11 — — CN claimed
WO-2022039460-A1 IMIDAZOLQUINOLINE OR BENZOINDAZOLONE COMPOUND AND INTERMEDIATE FOR PREPARING SAME 주식회사 엘마이토테라퓨틱스 2022-02-24 — — WO claimed
CN-115956071-A Imidazoquinoline or benzindazolone compounds and intermediates for their preparation LMITO药业株式会社 2023-04-11 — — CN disclosed
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