SCHEMBL4387465

SCHEMBL4387465

CCN(CC)C(=O)Cc1c(Br)c(O)cc(O)c1-c1ccco1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
CDC7 O00311 1/20 0.39
EEF2K O00418 1/20 0.39
PLK4 O00444 1/20 0.39
PDPK1 O15530 1/20 0.39
DYRK3 O43781 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 1/20 0.39
CHEK2 O96017 1/20 0.39
PIM1 P11309 1/20 0.39
PHKG2 P15735 1/20 0.39
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
MAPKAPK2 P49137 1/20 0.39
CLK2 P49760 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
RPS6KA3 P51812 1/20 0.39
NEK2 P51955 1/20 0.39
CSNK2A1 P68400 1/20 0.39

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
SCHEMBL4394076 0.81 ALDH1A1 (0.42) SMN1; SMN2GAAALDH1A1KDM4EMAPT
SCHEMBL4396312 0.80 ALDH1A1 (0.46) SMN1; SMN2GAAALDH1A1KDM4EMAPT
SCHEMBL4379960 0.77 ALDH1A1 (0.39) SMN1; SMN2CDC7EEF2KPLK4PDPK1
SCHEMBL4393970 0.76 ALDH1A1 (0.42) SMN1; SMN2GAAALDH1A1KDM4EMAPT
SCHEMBL4378161 0.73 POLB (0.49) SMN1; SMN2GAACYP1A2ALDH1A1KDM4E
SCHEMBL4382842 0.73 MEN1 (0.35) SMN1; SMN2GAAALDH1A1KDM4EMAPT
SCHEMBL4393899 0.69 L3MBTL1 (0.36) ALDH1A1KDM4EMAPTTDP1POLB
SCHEMBL4384668 0.67 NR4A2 (0.39) SMN1; SMN2CYP1A2KDM4EMAPTTDP1
SCHEMBL4388531 0.65 NPSR1 (0.41) SMN1; SMN2GAAALDH1A1MAPTTDP1
SCHEMBL4393895 0.63 LMNA (0.48) SMN1; SMN2CYP1A2ALDH1A1POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P SMN1; SMN2 4471/4885CDC7 439/4885EEF2K 1619/4885

“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.