SCHEMBL5778056

SCHEMBL5778056

CC(C)(C)OC(=O)NCc1ccc(C=NNc2ccc(-c3cnco3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
IMPDH2 P12268 3/20 0.42
IMPDH1 P20839 3/20 0.42
NAMPT P43490 2/20 0.42
VHL P40337 1/20 0.41
MIF P14174 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
RAB9A P51151 5/20 0.38
NPC1 O15118 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
RECQL P46063 1/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 3/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
CYP17A1 P05093 1/20 0.38
AAK1 Q2M2I8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL15110028 0.86 NAMPT (0.50) HDAC1HDAC6IMPDH2IMPDH1NAMPT
SCHEMBL5779933 0.85 NPC1 (0.44) IMPDH2IMPDH1VHLRAB9ANPC1
SCHEMBL5779930 0.85 NPC1 (0.44) IMPDH2IMPDH1VHLRAB9ANPC1
SCHEMBL5779773 0.81 LMNA (0.40) IMPDH2IMPDH1VHLRAB9ANPC1
SCHEMBL5779771 0.81 LMNA (0.40) IMPDH2IMPDH1VHLRAB9ANPC1
SCHEMBL5777066 0.79 NPC1 (0.46) IMPDH2IMPDH1RAB9ANPC1SMN1; SMN2
SCHEMBL5778053 0.79 NAMPT (0.47) HDAC1HDAC6IMPDH2IMPDH1NAMPT
SCHEMBL5775270 0.78 NPC1 (0.42) IMPDH2IMPDH1RAB9ANPC1SMN1; SMN2
SCHEMBL5777534 0.78 IMPDH2 (0.41) IMPDH2IMPDH1VHLGPR119RAB9A
SCHEMBL5775267 0.78 NPC1 (0.42) IMPDH2IMPDH1RAB9ANPC1SMN1; SMN2

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-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT HDAC1 64/4885HDAC6 351/4885IMPDH2 4694/4885

“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.