SCHEMBL234582

SCHEMBL234582

COC(=O)c1cc(I)cc(C(=O)c2ccc(NC(c3ccc(Cl)cc3)C3CC3)cn2)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
GCG P01275 4/20 0.37
P4HTM Q9NXG6 2/20 0.36
LTC4S Q16873 3/20 0.35
MAPK1 P28482 2/20 0.35
MAPT P10636 2/20 0.35
ATM Q13315 1/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
RECQL P46063 1/20 0.34
PRCP P42785 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
AKT1 P31749 1/20 0.33

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
SCHEMBL240030 0.83 LTC4S (0.42) GCGP4HTMLTC4S
SCHEMBL229858 0.78 MAPT (0.47) P4HTMMAPTMEN1KMT2ANPC1
SCHEMBL234583 0.76 LTC4S (0.60) LTC4S
SCHEMBL234584 0.75 ATM (0.39) P4HTMLTC4SMAPK1MAPTATM
SCHEMBL27832535 0.73 LTC4S (0.41) LTC4S
SCHEMBL9988057 0.71 LTC4S (0.50) LTC4S
SCHEMBL9988113 0.71 LTC4S (0.44) P4HTMLTC4SPOLB
SCHEMBL1721644 0.70 MDM2 (0.42) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL16752637 0.70 SMN1; SMN2 (0.47) MAPTMEN1KMT2ANPC1
SCHEMBL9988164 0.70 LTC4S (0.45) P4HTMLTC4S

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-2406220-A1 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS Biolipox AB (SE) 2012-01-18 EP disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
WO-2010103279-A1 BIS AROMATIC COMPOUNDS FOR USE AS LCT4 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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R PLA2G1B 341/4885ATG4B 2960/4885GCG 4552/4885

“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.