SCHEMBL4060094

SCHEMBL4060094

O=C1c2cnccc2CCc2ccc(OCc3ccc4cc(F)c(F)cc4n3)cc21

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
PDE10A Q9Y233 10/20 0.38
PDE4A P27815 3/20 0.38
PDE4B Q07343 3/20 0.38
PDE3B Q13370 2/20 0.36
PDE3A Q14432 2/20 0.36
CSNK1A1 P48729 1/20 0.35
CSNK1D P48730 1/20 0.35
GSK3B P49841 1/20 0.35
CSNK1G2 P78368 1/20 0.35
CYP19A1 P11511 1/20 0.35
MAPK14 Q16539 3/20 0.35
ALOX5AP P20292 1/20 0.34

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
SCHEMBL4057651 0.93 CYSLTR2 (0.38) CYSLTR2CYSLTR1PDE10APDE4APDE4B
SCHEMBL14159718 0.92 PDE10A (0.38) CYSLTR2CYSLTR1PDE10APDE4APDE4B
SCHEMBL4057661 0.84 PDE10A (0.42) CYSLTR2CYSLTR1PDE10AMAPK14
SCHEMBL14159683 0.83 PDE10A (0.38) CYSLTR2CYSLTR1PDE10APDE4APDE4B
SCHEMBL4057058 0.79 LTB4R (0.40) CYSLTR2CYSLTR1PDE10APDE4APDE4B
SCHEMBL13765232 0.78 PDE10A (0.39) CYSLTR2CYSLTR1PDE10AMAPK14ALOX5AP
SCHEMBL4055998 0.77 LTB4R (0.39) CYSLTR2CYSLTR1PDE10APDE4APDE4B
SCHEMBL4050759 0.76 CYSLTR2 (0.39) CYSLTR2CYSLTR1PDE10APDE4APDE4B
SCHEMBL4058667 0.74 SMN1; SMN2 (0.39) CYSLTR2CYSLTR1PDE10APDE4APDE4B
SCHEMBL4049859 0.74 CYSLTR2 (0.40) CYSLTR2CYSLTR1ALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
EP-1560834-B1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS ALMIRALL LAB (ES) 2008-06-25 EP disclosed
US-20060116363-A1 Tricyclic derivatives as ltd4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2006-06-01 US disclosed
EP-1560834-A1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS Almirall Prodesfarma, S.A. (ES) 2005-08-10 EP disclosed
WO-2004043966-A1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS ALMIRALL PRODESFARMA S.A. (ES) 2004-05-27 WO 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 (1 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-20060116363-A1 Tricyclic derivatives as ltd4 antagonists LTA4H, LTC4S, LTB4R2 CYSLTR2 7/4885CYSLTR1 6/4885PDE10A 2198/4885

“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.