SCHEMBL1724698

SCHEMBL1724698

CCCCCCSc1ccc(C(=O)c2ccc(N(C)c3ccc(Cl)cc3)cc2)cc1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 8/20 0.46
THRB P10828 5/20 0.41
CA2 P00918 1/20 0.40
LIPE Q05469 1/20 0.37
PTGS2 P35354 2/20 0.37
MAPT P10636 2/20 0.36
THRA P10827 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL237399 0.90 LTC4S (0.49) LTC4STHRB
SCHEMBL9988053 0.89 LTC4S (0.55) LTC4STHRBLIPE
SCHEMBL2948416 0.81 LTC4S (0.48) LTC4STHRBTHRAKDM4E
SCHEMBL9989448 0.79 LTC4S (0.45) LTC4SMAPTKDM4EALDH1A1
SCHEMBL2755485 0.79 LTC4S (0.72) LTC4S
SCHEMBL1724154 0.76 LTC4S (0.49) LTC4SMAPTKDM4EALDH1A1HPGD
SCHEMBL2888878 0.76 KDM4E (0.48) LTC4SCA2MAPTKDM4EALDH1A1
SCHEMBL2884843 0.75 POLB (0.53) LTC4SMAPTALDH1A1LMNAHPGD
SCHEMBL1723321 0.73 LTC4S (0.44) LTC4SMAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL231008 0.72 LTC4S (0.54) LTC4S

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
EP-2406223-A2 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS Biolipox AB (SE) 2012-01-18 EP disclosed
US-20110319431-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2011-12-29 US disclosed
WO-2010103297-A2 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS BIOLIPOX AB (SE) 2010-09-16 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-20110319431-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R LTC4S 1/4885THRB 831/4885CA2 3110/4885

“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.