SCHEMBL1678774

SCHEMBL1678774

CC(C)(C)Nc1cncc(Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.47
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GRM4 Q14833 1/20 0.36
LATS1 O95835 3/20 0.35
LATS2 Q9NRM7 2/20 0.35
CYP1A2 P05177 1/20 0.34
PDE4A P27815 1/20 0.34
CYP2C19 P33261 1/20 0.34
HRH1 P35367 5/20 0.34
DRD2 P14416 4/20 0.34
HTR2A P28223 4/20 0.34
GRM5 P41594 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CSF1R P07333 1/20 0.32
JAK2 O60674 1/20 0.31
JAK3 P52333 1/20 0.31

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
SCHEMBL15864925 0.77 CDK2 (0.54) CDK2GRM4LATS1LATS2HRH1
SCHEMBL12410783 0.77 ACP1 (0.33) LMNASMN1; SMN2LATS1LATS2CYP1A2
SCHEMBL4781903 0.76
SCHEMBL20951070 0.75 JAK2 (0.31) LMNASMN1; SMN2JAK2JAK3
SCHEMBL17700061 0.75 CDK2 (0.43) CDK2GRM4HRH1DRD2HTR2A
SCHEMBL23176200 0.72 CDK2 (0.48) CDK2GRM4CYP1A2CYP2C19HRH1
SCHEMBL21017434 0.72 IDH1 (0.39) CDK2LATS1JAK2JAK3
SCHEMBL15865230 0.71 CDK2 (0.48) CDK2GRM4HRH1DRD2HTR2A
SCHEMBL6305372 0.71
SCHEMBL6658388 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329737-B2 Benzimidazoles as selective kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2012-12-11 US disclosed
US-8329737-B2 Benzimidazoles as selective kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2012-12-11 US disclosed
EP-1704145-B1 SELECTIVE KINASE INHIBITORS YM BIOSCIENCES AUSTRALIA PTY (AU) 2012-06-13 EP disclosed
US-20110082142-A1 SELECTIVE KINASE INHIBITORS CYTOPIA RESEARCH PTY LTD (AU) 2011-04-07 US disclosed
US-20110082142-A1 SELECTIVE KINASE INHIBITORS CYTOPIA RESEARCH PTY LTD (AU) 2011-04-07 US disclosed
US-20080207613-A1 Selective Kinase Inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2008-08-28 US disclosed
US-20080207613-A1 Selective Kinase Inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2008-08-28 US disclosed
US-20080207613-A1 Selective Kinase Inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2008-08-28 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-20110082142-A1 SELECTIVE KINASE INHIBITORS LCK, CHUK, CSK CDK2 69/4885LMNA 4377/4885SMN1; SMN2 2297/4885
US-20080207613-A1 Selective Kinase Inhibitors LCK, CHUK, CSK CDK2 69/4885LMNA 4377/4885SMN1; SMN2 2297/4885

“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.