SCHEMBL2062237

SCHEMBL2062237

CC1(C)CCCN(C(=O)N2CCCC2)c2cc(N)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.40
ATAD2 Q6PL18 1/20 0.40
HSD11B1 P28845 1/20 0.39
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
GFER P55789 2/20 0.36
MAPT P10636 2/20 0.36
THRB P10828 2/20 0.36
ALOX15 P16050 1/20 0.36
YWHAG P61981 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTT P42858 1/20 0.35
AVPR2 P30518 2/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AVPR1A P37288 2/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL394831 0.85 NOTUM (0.42) BRD4ATAD2MEN1KMT2AKDM4E
SCHEMBL2060998 0.82 ALDH1A1 (0.45) HSD11B1MEN1KMT2AMAPTALDH1A1
SCHEMBL2061970 0.81 ALDH1A1 (0.42) BRD4ATAD2KDM4EGFERALOX15
SCHEMBL12693443 0.80 BRD4 (0.36) BRD4ATAD2MEN1KMT2AKDM4E
SCHEMBL2061297 0.79 BRD4 (0.38) BRD4ATAD2HSD11B1MEN1KMT2A
SCHEMBL4872561 0.77 NOTUM (0.44) BRD4ATAD2MEN1KMT2AGFER
SCHEMBL397583 0.77 RARB (0.40) BRD4ATAD2MEN1KMT2AKDM4E
SCHEMBL2062082 0.74 ALDH1A1 (0.41) MEN1KMT2AKDM4EHSD17B10HTT
SCHEMBL2912534 0.74 KMT2A (0.39) BRD4ATAD2MEN1KMT2AMAPT
SCHEMBL4430316 0.73 CA12 (0.39) BRD4ATAD2MEN1KMT2AKDM4E

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 BRD4 863/4885ATAD2 3694/4885HSD11B1 4122/4885
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors ALK, MET, RET BRD4 863/4885ATAD2 3694/4885HSD11B1 4122/4885

“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.