SCHEMBL238181

SCHEMBL238181

O=C(c1ccc([S+]([O-])c2ccc(Br)cc2)c(C(=O)O)c1)c1ccc(NCC2(c3ccc(Cl)cc3)CC2)cn1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 18/20 0.38
P2RX7 Q99572 1/20 0.36
P4HTM Q9NXG6 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
SCHEMBL9988043 0.90 LTC4S (0.45) LTC4SP2RX7P4HTM
SCHEMBL240304 0.90 LTC4S (0.42) LTC4S
SCHEMBL239167 0.84 LTC4S (0.39) LTC4S
SCHEMBL250947 0.84 LTC4S (0.44) LTC4SP2RX7
SCHEMBL237439 0.83 LTC4S (0.39) LTC4SP2RX7P4HTM
SCHEMBL238179 0.79 LTC4S (0.41) LTC4SP4HTM
SCHEMBL237853 0.76 P4HTM (0.46) LTC4SP4HTM
SCHEMBL238180 0.75 LTC4S (0.66) LTC4S
SCHEMBL240031 0.75 LTC4S (0.42) LTC4SP2RX7
SCHEMBL1722596 0.70 CNR1 (0.36) LTC4SP2RX7

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 1 patent. 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

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 1/4885P2RX7 1398/4885P4HTM 403/4885

“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.