SCHEMBL2755475

SCHEMBL2755475

O=C(c1ccc(Oc2ccccc2)c(C(=O)O)c1)c1ccc(OCc2ccc(C(F)(F)F)cc2)cn1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 2/20 0.49
P4HTM Q9NXG6 1/20 0.47
ALOX5 P09917 3/20 0.45
PSEN1 P49768 3/20 0.45
PPARG P37231 2/20 0.45
MRGPRX4 Q96LA9 2/20 0.45
MAOB P27338 3/20 0.45
MAPK14 Q16539 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
SCN9A Q15858 1/20 0.44
PPARA Q07869 1/20 0.43
NR4A2 P43354 1/20 0.43
PTGES O14684 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL2755474 0.91 NR4A2 (0.56) LTC4SP4HTMMRGPRX4MAOBMAPK14
SCHEMBL236056 0.84 PTGDR2 (0.47) LTC4SP4HTMMRGPRX4MAOB
SCHEMBL239586 0.83 P4HTM (0.49) P4HTMMRGPRX4MAOBPTGES
SCHEMBL239377 0.82 RXRA (0.54) LTC4SP4HTMMRGPRX4MAOBRXRA
SCHEMBL239379 0.81 LTC4S (0.73) LTC4S
SCHEMBL238898 0.79 SCN9A (0.49) LTC4SSCN9A
SCHEMBL2755403 0.78 LTC4S (0.58) LTC4SSCN9A
SCHEMBL2755473 0.76 RXRA (0.51) LTC4SMRGPRX4MAOBRXRARXRB
SCHEMBL238805 0.76 LTC4S (0.63) LTC4S
SCHEMBL241183 0.76 LTC4S (0.51) LTC4SSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004244-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20120004244-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 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 (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-20120004244-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R LTC4S 1/4885P4HTM 403/4885ALOX5 17/4885

“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.