SCHEMBL9868870

SCHEMBL9868870

CSC(=O)c1cnccc1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 5/20 0.53
▸ KDM6B O15054 4/20 0.53
▸ ALKBH2 Q6NS38 1/20 0.53
▸ ALKBH3 Q96Q83 1/20 0.53
▸ KDM5B Q9UGL1 1/20 0.53
▸ KDM2A Q9Y2K7 1/20 0.53
▸ KDM3A Q9Y4C1 1/20 0.53
▸ TBXAS1 P24557 3/20 0.42
▸ KDM4C Q9H3R0 3/20 0.40
▸ KDM4D Q6B0I6 2/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ KDM4A O75164 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ NAPRT Q6XQN6 1/20 0.38
▸ PLA2G7 Q13093 1/20 0.38

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
SCHEMBL258224 0.83 KDM6B (0.59) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL7020789 0.81 TSHR (0.53) TSHR
SCHEMBL9870441 0.80 FTO (0.56) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL6491004 0.79 FTO (0.56) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL7109229 0.77 FTO (0.51) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL9870443 0.76 FTO (0.52) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL11628317 0.74 NAPRT (0.53) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL9868876 0.73 FTO (0.50) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL4951259 0.73 KDM4C (0.56) FTOKDM6BALKBH2ALKBH3KDM5B
SCHEMBL15109804 0.72 KDM4E (0.44) KDM4ETSHR

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
US-5006532-A Enzyme inhibitor; antiinflammatory agents MERCK & CO. INC., INC. (US) 1991-04-09 — — US disclosed
US-4904672-A Derivatives of 3-hydroxyazabenzo[b]thiophene useful as 5-lipoxygenase inhibitors MERCK & CO., INC. (US) 1990-02-27 — — US disclosed
US-4767766-A Derivatives of 3-hydroxyazabenzo(B)thiophene useful as 5-lipoxygenase inhibitors MERCK & CO., INC. (US) 1988-08-30 — — US disclosed
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