SCHEMBL2983690

SCHEMBL2983690

Cc1nc(-c2cc(=O)oc3cc(Sc4ncc(C(O)(C5CC5)C5CC5)s4)ccc23)cs1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MLYCD O95822 2/20 0.62
▸ MIF P14174 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ ALOX5 P09917 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ADORA2A P29274 1/20 0.30
▸ GAA P10253 1/20 0.30

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
SCHEMBL2991999 0.86 MLYCD (0.82) MLYCDMIFKDM4EMAPTHPGD
SCHEMBL2992122 0.85 MLYCD (0.52) MLYCDKDM4EMAPTHPGDKMT2A
SCHEMBL2983967 0.84 MLYCD (0.68) MLYCDMIFKDM4EMAPTHPGD
SCHEMBL2975439 0.84 MLYCD (0.53) MLYCDKDM4EMAPTHPGDKMT2A
SCHEMBL2989701 0.83 MLYCD (0.50) MLYCDKDM4EMAPTHPGDKMT2A
SCHEMBL2994598 0.83 MLYCD (0.53) MLYCDKDM4EMAPTHPGDKMT2A
SCHEMBL2986064 0.82 MLYCD (0.54) MLYCDKDM4EHPGDKMT2AALOX5
SCHEMBL2989592 0.82 MLYCD (0.52) MLYCDKDM4EMAPTHPGDKMT2A
SCHEMBL2977185 0.82 MLYCD (0.50) MLYCDKDM4EMAPTHPGDMEN1
SCHEMBL2977302 0.81 MLYCD (0.51) MLYCDKDM4EMAPTHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7439260-B2 7-(1,3-thiazol-2-YL)thio-coumarin derivatives and their use as leukotriene biosynthesis inhibitors MERCK FORSST CANADA & CO. (CA) 2008-10-21 — — US claimed
US-20060116406-A1 7-(1,3-thiazol-2-yl)thio!-coumarin derivatives and their use as leukotriene biosynthesis inhibitors GAREAU YVES 2006-06-01 — — US claimed
US-20100137371-A1 Novel Pharmaceutical Compounds MERCK FROSST CANADA LTD. (CA) 2010-06-03 — — US disclosed
US-7439260-B2 7-(1,3-thiazol-2-YL)thio-coumarin derivatives and their use as leukotriene biosynthesis inhibitors MERCK FORSST CANADA & CO. (CA) 2008-10-21 — — US disclosed
US-20060116406-A1 7-(1,3-thiazol-2-yl)thio!-coumarin derivatives and their use as leukotriene biosynthesis inhibitors GAREAU YVES 2006-06-01 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060116406-A1 7-(1,3-thiazol-2-yl)thio!-coumarin derivatives and their use as leukotriene biosynthesis inhibitors LTC4S, LTA4H, CYSLTR1 MLYCD 2142/4885MIF 27/4885KDM4E 4278/4885
US-20100137371-A1 Novel Pharmaceutical Compounds LTC4S, LTA4H, LTB4R2 MLYCD 2597/4885MIF 38/4885KDM4E 3454/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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