SCHEMBL13020169

SCHEMBL13020169

CCC(=O)Nc1ncnc2c1c(-c1cccc(Cl)c1)cn2C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.45
SRC P12931 3/20 0.44
KDR P35968 3/20 0.44
LCK P06239 2/20 0.44
TEK Q02763 2/20 0.44
TP53 P04637 2/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
ABL2 P42684 1/20 0.39
ADK P55263 3/20 0.39
ADORA1 P30542 1/20 0.39
CNR2 P34972 1/20 0.38
GSK3B P49841 1/20 0.38
RET P07949 2/20 0.37
STK4 Q13043 1/20 0.37

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
SCHEMBL13020175 0.88 LCK (0.58) VCPSRCKDRLCKTEK
SCHEMBL13020166 0.83 GSK3B (0.49) SRCKDRLCKTEKTP53
SCHEMBL13020146 0.77 SRC (0.73) SRCKDRLCKTEKABL1
SCHEMBL13020173 0.76 KDM4E (0.63) SRCKDRLCKTEKLMNA
SCHEMBL13020347 0.74 KDR (0.56) SRCKDRLCKTEKKDM4E
SCHEMBL13020123 0.73 LCK (0.58) SRCKDRLCKTEKLMNA
SCHEMBL13020030 0.73 ADK (0.52) SRCKDRLCKTEKLMNA
SCHEMBL13020126 0.72 VCP (0.49) VCPSRCKDRLCKLMNA
SCHEMBL2783845 0.70 MAPT (0.71) SRCTP53LMNAMAPTEGFR
SCHEMBL13019982 0.69 HTT (0.78) VCPSRCKDRLCKTEK

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 VCP 146/4885SRC 1332/4885KDR 4598/4885

“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.