SCHEMBL159594

SCHEMBL159594

N#CCc1ccc(-c2ccc(OCCN3CCOCC3)cc2)cn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
HRH3 Q9Y5N1 2/20 0.58
HRH2 P25021 1/20 0.58
HRH1 P35367 1/20 0.58
SRC P12931 6/20 0.56
ABL1 P00519 1/20 0.56
TUBB4A P04350 1/20 0.56
TUBB P07437 1/20 0.56
LYN P07948 1/20 0.56
TUBA3C P0DPH7 1/20 0.56
BCR P11274 1/20 0.56
TUBA1B P68363 1/20 0.56
TUBA4A P68366 1/20 0.56
TUBB4B P68371 1/20 0.56
TUBB3 Q13509 1/20 0.56
TUBB2A Q13885 1/20 0.56
TUBB8 Q3ZCM7 1/20 0.56
TUBA3E Q6PEY2 1/20 0.56
TUBA1A Q71U36 1/20 0.56

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
SCHEMBL12158775 0.84 NPC1 (0.62) NPC1RAB9AHRH3HRH2HRH1
SCHEMBL10085622 0.81 SRC (0.59) NPC1RAB9AHRH3HRH2HRH1
SCHEMBL254273 0.81 TUBB4A (0.72) NPC1RAB9AHRH3SRCABL1
SCHEMBL12993444 0.80 SRC (0.68) NPC1RAB9AHRH3SRCABL1
SCHEMBL18430928 0.79 NPC1 (0.65) NPC1RAB9AHRH3HRH2HRH1
SCHEMBL157758 0.79 NPC1 (0.65) NPC1RAB9AHRH3HRH2HRH1
SCHEMBL29506836 0.79 NPC1 (0.65) NPC1RAB9AHRH3HRH2HRH1
SCHEMBL19292009 0.79 NPC1 (0.65) NPC1RAB9AHRH3HRH2HRH1
SCHEMBL12158770 0.79 NPC1 (0.65) NPC1RAB9AHRH3HRH2HRH1
SCHEMBL15498499 0.79 SRC (0.47) SRCPRKAB1KDRACVR1

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 96 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2155681-B1 PROCESS FOR THE PREPARATION OF COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF ATHENEX INC (US) 2018-05-02 EP claimed
EP-2114934-B1 COMPOSITION AND METHODS FOR MODULATING A KINASE CASCADE KINEX PHARMACEUTICALS LLC (US) 2015-10-21 EP claimed
US-7939529-B2 Substantially pure 2-(5-(4-(2-morpholinoethoxy)phenyl)pyridin-2-yl)-N-benzylacetamide salts, solvates, hydrates, prodrugs; hyperproliferative disorders, cancers, pre-cancers, osteoporosis, cardiovascular disorders; bacterial, fungal, parasitic or viral infection KINEX PHARMACEUTICALS, LLC (US) 2011-05-10 US claimed
EP-2155681-A1 PROCESS FOR THE PREPARATION OF COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF Kinex Pharmaceuticals, LLC (US) 2010-02-24 EP claimed
WO-2008144045-A1 PROCESS FOR THE PREPARATION OF COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF KINEX PHARMACEUTICALS, LLC (US) 2008-11-27 WO claimed
US-20080287436-A1 Process for the preparation of compositions for modulating a kinase cascade and methods of use thereof SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2008-11-20 US claimed
US-20240343691-A1 COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF ATNX SPV LLC (US) 2024-10-17 US disclosed
US-20220160672-A1 PHARMACEUTICAL COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2022-05-26 US disclosed
US-20220160672-A1 PHARMACEUTICAL COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2022-05-26 US disclosed
US-20210198202-A1 COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2021-07-01 US disclosed
US-20210198202-A1 COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2021-07-01 US disclosed
EP-3777832-A1 PHARMACEUTICAL COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF Athenex, Inc. (US) 2021-02-17 EP disclosed
EP-3777832-A1 PHARMACEUTICAL COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF Athenex, Inc. (US) 2021-02-17 EP disclosed
WO-2008082637-A9 COMPOSITION AND METHODS FOR MODULATING A KINASE CASCADE KINEX PHARMACEUTICALS LLC (US) 2008-09-18 WO disclosed
WO-2008082637-A9 COMPOSITION AND METHODS FOR MODULATING A KINASE CASCADE KINEX PHARMACEUTICALS LLC (US) 2008-09-18 WO disclosed
US-20080221102-A1 Composition and methods for modulating a kinase cascade SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2008-09-11 US disclosed
US-20080221102-A1 Composition and methods for modulating a kinase cascade SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2008-09-11 US disclosed
US-20080221102-A1 Composition and methods for modulating a kinase cascade SAGARD HEALTHCARE ROYALTY PARTNERS, LP, AS ADMINISTRATIVE AGENT (CA) 2008-09-11 US disclosed
WO-2008082637-A1 COMPOSITION AND METHODS FOR MODULATING A KINASE CASCADE KINEX PHARMACEUTICALS, LLC (US) 2008-07-10 WO disclosed
WO-2008082637-A1 COMPOSITION AND METHODS FOR MODULATING A KINASE CASCADE KINEX PHARMACEUTICALS, LLC (US) 2008-07-10 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 (5 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-20080221102-A1 Composition and methods for modulating a kinase cascade MAP3K4, MAP3K6, MAP3K3 NPC1 3753/4885RAB9A 3365/4885HRH3 2718/4885
US-20080287436-A1 Process for the preparation of compositions for modulating a kinase cascade and methods of use thereof MAP3K2, MAP3K6, MAP3K4 NPC1 4591/4885RAB9A 2750/4885HRH3 2522/4885
US-20220160672-A1 PHARMACEUTICAL COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF MAP3K2, MAP3K6, MAP3K10 NPC1 1437/4885RAB9A 1994/4885HRH3 1495/4885
US-20240343691-A1 COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF MAP3K2, MAP3K4, MAP3K5 NPC1 4682/4885RAB9A 2727/4885HRH3 2330/4885
US-20210198202-A1 COMPOSITIONS FOR MODULATING A KINASE CASCADE AND METHODS OF USE THEREOF MAP3K2, MAP3K4, MAP3K5 NPC1 4693/4885RAB9A 2953/4885HRH3 2342/4885

“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.