SCHEMBL8798449

SCHEMBL8798449

CC(=O)SCC1(CO)CC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.32
POLB P06746 1/20 0.31
BLM P54132 1/20 0.31
ATM Q13315 1/20 0.31
ACE P12821 1/20 0.31

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
SCHEMBL2855195 0.78 CYP1A2 (0.39) CYP2C19BLMACE
SCHEMBL2733522 0.77
SCHEMBL625848 0.74 MGAM (0.35)
SCHEMBL13242751 0.71
SCHEMBL9200803 0.71 GAA (0.38)
SCHEMBL22687503 0.70
SCHEMBL3305213 0.70 CYP2C19 (0.30) CYP2C19
SCHEMBL18632488 0.69 POLB (0.34) POLB
SCHEMBL22023035 0.68 ACE (0.32) ACE
Acetic Acid SCHEMBL595825 0.68 FFAR3 (0.33) CYP2C19POLBBLMATMACE

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
EP-1948611-B1 Process for the preparation of a leukotriene antagonist and intermediates thereof ESTEVE QUIMICA SA (ES) 2012-05-23 EP disclosed
US-20080306270-A1 Process for the Preparation of a Leukotriene Antagonist and Intermediates Thereof Esteve Química, S.A. (ES) 2008-12-11 US disclosed
US-20080306270-A1 Process for the Preparation of a Leukotriene Antagonist and Intermediates Thereof Esteve Química, S.A. (ES) 2008-12-11 US disclosed
WO-2007051828-A2 PROCESS FOR THE PREPARATION OF A LEUKOTRIENE ANTAGONIST AND INTERMEDIATES THEREOF ESTEVE QUÍMICA, S. A. (ES) 2007-05-10 WO disclosed
EP-1783117-A1 Process for the preparation of a leukotriene antagonist and intermediates thereof ESTEVE QUIMICA, S.A. (ES) 2007-05-09 EP 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-20080306270-A1 Process for the Preparation of a Leukotriene Antagonist and Intermediates Thereof LTC4S, LTB4R, CYSLTR1 CYP2C19 111/4885POLB 2161/4885BLM 4165/4885

“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.