SCHEMBL10132968

SCHEMBL10132968

CN1CCN(CCOc2ccc(-c3ccc(NC(=O)NCc4ccccc4)cc3)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 4/20 0.61
▸ AURKB Q96GD4 2/20 0.61
▸ LTA4H P09960 2/20 0.56
▸ KDR P35968 1/20 0.55
▸ FLT3 P36888 1/20 0.55
▸ RAB9A P51151 3/20 0.54
▸ KCNA5 P22460 3/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ PIK3CA P42336 1/20 0.54
▸ MTOR P42345 1/20 0.54
▸ EPHX2 P34913 2/20 0.52
▸ ABL1 P00519 1/20 0.52
▸ TUBB4A P04350 1/20 0.52
▸ TUBB P07437 1/20 0.52
▸ LYN P07948 1/20 0.52
▸ TUBA3C P0DPH7 1/20 0.52
▸ BCR P11274 1/20 0.52
▸ SRC P12931 1/20 0.52
▸ TUBA1B P68363 1/20 0.52

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
SCHEMBL10132797 0.89 EPHX2 (0.67) AURKAAURKBLTA4HKDRFLT3
SCHEMBL10133030 0.88 TUBB4A (0.58) AURKAAURKBLTA4HKDRFLT3
SCHEMBL10132973 0.85 LTA4H (0.58) LTA4HKDRFLT3RAB9ANPC1
SCHEMBL10132964 0.84 TUBB4A (0.63) LTA4HRAB9AALDH1A1NPC1ABL1
SCHEMBL10132925 0.84 EPHX2 (0.75) AURKAAURKBKDRFLT3EPHX2
SCHEMBL11917546 0.79 TUBB4A (0.81) LTA4HRAB9ANPC1ABL1TUBB4A
SCHEMBL10133026 0.79 TUBB4A (0.57) AURKALTA4HKDRFLT3RAB9A
SCHEMBL10132985 0.78 LTA4H (0.64) AURKALTA4HRAB9ANPC1
SCHEMBL10132967 0.78 LTA4H (0.64) LTA4HRAB9ANPC1
SCHEMBL10132906 0.78 EPHX2 (0.57) AURKAAURKBKDRFLT3RAB9A

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 AURKA 278/4885AURKB 151/4885LTA4H 3326/4885

“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.

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