SCHEMBL2060937

SCHEMBL2060937

CS(=O)(=O)N[C@H]1CC[C@H](Nc2nc(Cl)ncc2Cl)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.47
KMT2A Q03164 1/20 0.46
SMO Q99835 12/20 0.45
MAPK8 P45983 1/20 0.44
CCNT1 O60563 1/20 0.43
JAK1 P23458 2/20 0.43
AURKB Q96GD4 2/20 0.43
AURKA O14965 1/20 0.43
CDK7 P50613 1/20 0.42
CDK9 P50750 1/20 0.42
PRCP P42785 1/20 0.41
JAK2 O60674 1/20 0.41
FLT3 P36888 1/20 0.41

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
SCHEMBL2060936 1.00 ALK (0.47) ALKKMT2ASMOMAPK8CCNT1
SCHEMBL2061471 1.00 ALK (0.47) ALKKMT2ASMOMAPK8CCNT1
SCHEMBL2060366 0.87 KMT2A (0.45) ALKKMT2ASMOJAK1AURKB
SCHEMBL2062697 0.87 KMT2A (0.45) ALKKMT2ASMOJAK1AURKB
SCHEMBL844926 0.85 KMT2A (0.58) KMT2AJAK1CDK7CDK9JAK2
SCHEMBL2060390 0.82 ALK (0.49) ALKKMT2ASMOJAK1AURKB
SCHEMBL2060480 0.82 ALK (0.52) ALKKMT2ASMOJAK1AURKB
SCHEMBL2060389 0.82 ALK (0.49) ALKKMT2ASMOJAK1AURKB
SCHEMBL2060387 0.82 ALK (0.49) ALKKMT2ASMOJAK1AURKB
SCHEMBL2061744 0.82 ALK (0.52) ALKKMT2ASMOJAK1AURKB

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 7 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
US-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2009-09-03 US 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 ALK 1/4885KMT2A 501/4885SMO 433/4885
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors ALK, MET, RET ALK 1/4885KMT2A 501/4885SMO 433/4885

“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.