SCHEMBL231747

SCHEMBL231747

CN(c1ccc(Cl)cc1)c1ccc(C(=O)c2cc(C(=O)O)cc(N(C(=O)C3CCC3)c3ccccc3)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 13/20 0.44
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SRD5A2 P31213 2/20 0.38
RHOA P61586 1/20 0.38
CXCR3 P49682 1/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 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
SCHEMBL230183 0.91 LTC4S (0.38) LTC4SLMNAL3MBTL1SRD5A2NPC1
SCHEMBL231849 0.90 LMNA (0.40) LTC4SLMNAL3MBTL1RHOACXCR3
SCHEMBL230136 0.83 SRD5A2 (0.51) LTC4SLMNAL3MBTL1SRD5A2NPC1
SCHEMBL2743206 0.83 LTC4S (0.49) LTC4SLMNAL3MBTL1SRD5A2
SCHEMBL2743202 0.81 LTC4S (0.49) LTC4SLMNAL3MBTL1SRD5A2
SCHEMBL232237 0.80 SRD5A2 (0.56) LTC4SLMNAL3MBTL1SRD5A2NPC1
SCHEMBL2743204 0.78 LMNA (0.41) LTC4SLMNAL3MBTL1SRD5A2NPC1
SCHEMBL2743193 0.76 LMNA (0.44) LTC4SLMNAL3MBTL1SRD5A2NPC1
SCHEMBL2743203 0.76 RXRA (0.41) LTC4SLMNAL3MBTL1SRD5A2NPC1
SCHEMBL13155510 0.76 LTC4S (0.34) LTC4SLMNAL3MBTL1CXCR3

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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20120004228-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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R LTC4S 1/4885LMNA 1141/4885L3MBTL1 324/4885

“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.