SCHEMBL13020113

SCHEMBL13020113

CCn1cc(-c2ccc(Cl)cc2)c2c(NC(=O)NC(C)C)ncnc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADK P55263 7/20 0.47
FLT3 P36888 2/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
CA12 O43570 6/20 0.39
CA1 P00915 6/20 0.39
CA2 P00918 6/20 0.39
CA9 Q16790 6/20 0.39
SIGMAR1 Q99720 1/20 0.39
PDE11A Q9HCR9 1/20 0.38
LMNA P02545 1/20 0.37
LCK P06239 1/20 0.36
SRC P12931 1/20 0.36
KDR P35968 1/20 0.36
TEK Q02763 1/20 0.36

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
SCHEMBL13020121 0.88 ADK (0.49) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL3789169 0.86 KDM4E (0.54) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL13020030 0.85 ADK (0.52) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL13020106 0.83 ADK (0.49) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL13020139 0.82 GSK3B (0.49) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL13020031 0.82 ADK (0.54) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL13020080 0.81 ADK (0.47) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL13020081 0.80 ADK (0.46) ADKFLT3KDM4EALDH1A1HTT
SCHEMBL3784312 0.78 CA12 (0.47) ADKALDH1A1CA12CA1CA2
SCHEMBL3788058 0.73 KDM4E (0.54) ADKFLT3KDM4EALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 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 (1 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-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING RAB1A, COPB1, GOLT1B ADK 3845/4885FLT3 4342/4885KDM4E 4425/4885

“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.