SCHEMBL5779514

SCHEMBL5779514

CN(C)CC(=O)Nc1ccc(/C=N/Nc2ccc(-c3cnco3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.50
PORCN Q9H237 1/20 0.46
IMPDH2 P12268 3/20 0.46
IMPDH1 P20839 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
AAK1 Q2M2I8 1/20 0.45
NPC1 O15118 6/20 0.45
RAB9A P51151 5/20 0.45
KDM4E B2RXH2 4/20 0.45
PKM P14618 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
NOX1 Q9Y5S8 1/20 0.42
JAK3 P52333 1/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
HTT P42858 1/20 0.41
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40

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
SCHEMBL5779523 1.00 TAAR1 (0.50) TAAR1PORCNIMPDH2IMPDH1MEN1
SCHEMBL5780111 0.85 NOX1 (0.60) PORCNIMPDH2IMPDH1MEN1KMT2A
SCHEMBL5780110 0.85 NOX1 (0.60) PORCNIMPDH2IMPDH1MEN1KMT2A
SCHEMBL5779459 0.83 NPC1 (0.46) IMPDH2IMPDH1MEN1KMT2AAAK1
SCHEMBL5779782 0.82 LMNA (0.40) IMPDH2IMPDH1MEN1KMT2AAAK1
SCHEMBL5779785 0.82 LMNA (0.40) IMPDH2IMPDH1MEN1KMT2AAAK1
SCHEMBL5775270 0.82 NPC1 (0.42) PORCNIMPDH2IMPDH1MEN1KMT2A
SCHEMBL5777532 0.82 IMPDH2 (0.41) PORCNIMPDH2IMPDH1MEN1KMT2A
SCHEMBL5775267 0.82 NPC1 (0.42) PORCNIMPDH2IMPDH1MEN1KMT2A
SCHEMBL5777534 0.82 IMPDH2 (0.41) PORCNIMPDH2IMPDH1MEN1KMT2A

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 TAAR1 793/4885PORCN 3789/4885IMPDH2 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.