SCHEMBL2062389

SCHEMBL2062389

CCCN1CCc2cc(N)c(OC)cc2CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 3/20 0.55
MAOA P21397 2/20 0.46
MAOB P27338 2/20 0.46
SLC6A4 P31645 1/20 0.46
HTR4 Q13639 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
DRD2 P14416 1/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 2/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 1/20 0.43
DHFR P00374 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL2060786 0.87 ABCB1 (0.50) ABCB1MAOAMAOBSLC6A4L3MBTL1
SCHEMBL519316 0.86 ABCB1 (0.47) ABCB1MAOAMAOBSLC6A4HTR4
SCHEMBL519439 0.86 DRD2 (0.47) ABCB1MAOAMAOBSLC6A4HTR4
SCHEMBL2061715 0.85 SYK (0.48) ABCB1MAOAMAOBSLC6A4L3MBTL1
SCHEMBL2204044 0.84 ABCB1 (0.46) ABCB1MAOAMAOBSLC6A4HTR4
SCHEMBL2571297 0.83 MAOB (0.65) ABCB1MAOAMAOBSLC6A4DRD2
SCHEMBL22864687 0.83 ABCB1 (0.57) ABCB1MAOAMAOBSLC6A4L3MBTL1
SCHEMBL2061123 0.82 CA7 (0.47) ABCB1MAOAMAOBSLC6A4L3MBTL1
SCHEMBL25568846 0.81 ABCB1 (0.80) ABCB1MAOAMAOBSLC6A4L3MBTL1
SCHEMBL2207816 0.80 ABCB1 (0.57) ABCB1MAOAMAOBSLC6A4L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2684874-B1 Fused bicyclic derivatives of 2,4-diaminopyrimidine as alk and C-met inhibitors CEPHALON INC (US) 2017-05-17 EP disclosed
EP-2222647-B1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS CEPHALON INC (US) 2015-08-05 EP disclosed
EP-2684874-A1 Fused bicyclic derivatives of 2,4-diaminopyrimidine as alk and C-met inhibitors Cephalon, Inc. (US) 2014-01-15 EP disclosed
US-8552186-B2 Fused bicyclic derivatives of 2,4-diaminopyrimidine as ALK and c-MET inhibitors CEPHALON, INC. (US) 2013-10-08 US disclosed
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors CEPHALON, INC. (US) 2012-06-28 US disclosed
US-8148391-B2 Fused bicyclic derivatives of 2,4-diaminopyrimidine as ALK and c-Met inhibitors CEPHALON, INC. (US) 2012-04-03 US disclosed
EP-2222647-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS Cephalon, Inc. (US) 2010-09-01 EP disclosed
US-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2009-09-03 US disclosed
WO-2008051547-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS CEPHALON, INC. (US) 2008-05-02 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 (2 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-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS ALK, MET, RET ABCB1 265/4885MAOA 2937/4885MAOB 2123/4885
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors ALK, MET, RET ABCB1 265/4885MAOA 2937/4885MAOB 2123/4885

“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.