SCHEMBL237289

SCHEMBL237289

O=C(c1ccc(Oc2ccccc2)c(C(=O)O)c1)c1ccc(Nc2ccc(Cl)cc2)cn1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 14/20 0.49
KCNQ3 O43525 1/20 0.45
KCNQ2 O43526 1/20 0.45
KCNE1 P15382 1/20 0.45
KCNQ1 P51787 1/20 0.45
P4HTM Q9NXG6 1/20 0.44
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43

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
SCHEMBL239632 0.91 LTC4S (0.47) LTC4SKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL240022 0.86 LTC4S (0.49) LTC4S
SCHEMBL239013 0.82 LTC4S (0.69) LTC4S
SCHEMBL239488 0.80 KMT2A (0.43) KCNQ3KCNQ2KCNE1KCNQ1AKR1C3
SCHEMBL236052 0.80 LTC4S (0.45) LTC4S
SCHEMBL239346 0.78 LTC4S (0.54) LTC4S
SCHEMBL239427 0.78 LTC4S (0.53) LTC4S
SCHEMBL239894 0.78 KMT2A (0.43) LTC4SKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL236114 0.77 LTC4S (0.72) LTC4S
SCHEMBL239832 0.77 LTC4S (0.69) 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
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
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 1/4885KCNQ3 1736/4885KCNQ2 1925/4885

“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.