SCHEMBL5772692

SCHEMBL5772692

CC(C)=NNc1ccc(-c2cnco2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.53
LMNA P02545 2/20 0.53
IMPDH2 P12268 2/20 0.50
KMT2A Q03164 2/20 0.50
IMPDH1 P20839 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 4/20 0.49
KDM4E B2RXH2 3/20 0.49
RAB9A P51151 3/20 0.49
ALDH1A1 P00352 2/20 0.49
NOTUM Q6P988 1/20 0.49
GAA P10253 1/20 0.49
PTK2 Q05397 1/20 0.47
AAK1 Q2M2I8 1/20 0.46
POLB P06746 1/20 0.46
KEAP1 Q14145 1/20 0.45
JAK3 P52333 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 2/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL5780133 0.83 ALDH1A1 (0.58) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL5777808 0.81 KMT2A (0.47) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL8171366 0.76 PKM (0.63) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL28985219 0.76 KMT2A (0.67) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL5778956 0.76 NPC1 (0.56) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL10768177 0.75 PKM (0.78) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL5780459 0.74 NPC1 (0.55) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL5780457 0.74 NPC1 (0.55) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL5778492 0.74 NPC1 (0.57) PKMLMNAIMPDH2KMT2AIMPDH1
SCHEMBL5776770 0.73 PKM (0.58) PKMLMNAIMPDH2KMT2AIMPDH1

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 PKM 3411/4885LMNA 861/4885IMPDH2 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.