SCHEMBL232108

SCHEMBL232108

COC(=O)c1cc(Nc2ccccc2)cc(C(=O)c2ccc(N(C)c3ccc(Cl)cc3)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
KDR P35968 1/20 0.43
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 1/20 0.41
LTC4S Q16873 3/20 0.40
HPGD P15428 3/20 0.40
PTGS2 P35354 1/20 0.39
HTT P42858 2/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL2743185 0.90 MAPK13 (0.47) MAPTRAB9ANPC1LMNAL3MBTL1
SCHEMBL232232 0.88 LMNA (0.50) MAPTRAB9ANPC1NPSR1LMNA
SCHEMBL231986 0.88 RAB9A (0.47) MAPTRAB9ANPC1NPSR1LMNA
SCHEMBL232166 0.87 LTC4S (0.54) LTC4S
SCHEMBL232400 0.85 HPGD (0.46) MAPTRAB9ANPC1NPSR1LMNA
SCHEMBL230366 0.85 MAPT (0.51) MAPTRAB9ANPC1NPSR1LMNA
SCHEMBL2743184 0.84 SRD5A2 (0.47) MAPTNPC1LMNAL3MBTL1MAPK13
SCHEMBL231253 0.84 LMNA (0.46) MAPTRAB9ANPC1LMNAL3MBTL1
SCHEMBL229900 0.82 TUBB4A (0.45) MAPTRAB9ANPC1NPSR1LMNA
SCHEMBL230032 0.82 MAPT (0.44) MAPTRAB9ANPC1NPSR1LMNA

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 MAPT 4117/4885RAB9A 3916/4885NPC1 2560/4885

“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.