SCHEMBL10133002

SCHEMBL10133002

CN1CCN(CCOc2ccc(-c3ccc(C/C(F)=C/Cc4ccccc4)cc3)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 12/20 0.60
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
TP53 P04637 1/20 0.46
MAPK1 P28482 1/20 0.46
KCNH2 Q12809 1/20 0.45

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
SCHEMBL10132871 0.88 NPC1 (0.62) LTA4HRAB9ANPC1
SCHEMBL10133007 0.88 TUBB4A (0.53) LTA4HRAB9ANPC1MAPK1
SCHEMBL10132935 0.83 EPHX2 (0.57) LTA4HRAB9ANPC1MAPK1KCNH2
SCHEMBL10132875 0.78 SRC (0.58) LTA4HRAB9ANPC1KCNH2
SCHEMBL10132876 0.77 ESR1 (0.54) LTA4HRAB9ANPC1
SCHEMBL10132993 0.77 LTA4H (0.61) LTA4HRAB9ANPC1KCNH2
SCHEMBL10132873 0.77 TUBB4A (0.66) LTA4HRAB9ANPC1
SCHEMBL10132938 0.77 NPC1 (0.47) LTA4HRAB9ANPC1KCNH2
SCHEMBL10132987 0.77 LTA4H (0.60) LTA4HRAB9ANPC1
SCHEMBL10132964 0.77 TUBB4A (0.63) LTA4HRAB9ANPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124605-B2 Compositions and methods for modulating a kinase cascade KINEX PHARMACEUTICALS, LLC (US) 2012-02-28 US disclosed
US-8124605-B2 Compositions and methods for modulating a kinase cascade KINEX PHARMACEUTICALS, LLC (US) 2012-02-28 US disclosed
US-20090149510-A1 Compositions and methods for modulating a kinase cascade OAKTREE FUND ADMINISTRATION, LLC 2009-06-11 US disclosed
US-20090149510-A1 Compositions and methods for modulating a kinase cascade OAKTREE FUND ADMINISTRATION, LLC 2009-06-11 US disclosed
WO-2009009041-A2 COMPOSITIONS AND METHODS FOR MODULATING A KINASE CASCADE KINEX PHARMACEUTICALS, LLC (US) 2009-01-15 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-20090149510-A1 Compositions and methods for modulating a kinase cascade MAP3K6, MAP3K4, MAP3K3 LTA4H 3326/4885RAB9A 2804/4885NPC1 3447/4885

“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.