SCHEMBL5777570

SCHEMBL5777570

C(=NNc1ccc(-c2cnco2)cc1)c1ccnc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.58
KMT2A Q03164 7/20 0.58
MEN1 O00255 6/20 0.58
NPC1 O15118 5/20 0.58
GAA P10253 5/20 0.58
MAPT P10636 3/20 0.58
MAPK1 P28482 1/20 0.58
HPGD P15428 2/20 0.47
ALDH1A1 P00352 2/20 0.47
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
HTT P42858 1/20 0.46
LMNA P02545 2/20 0.41
PKM P14618 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CD38 P28907 1/20 0.40
PTK2 Q05397 1/20 0.38
PORCN Q9H237 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
SCHEMBL5777482 0.79 KDM4E (0.47) RAB9AKMT2ANPC1GAAMAPT
SCHEMBL5778811 0.78 NOX1 (0.54) RAB9AKMT2AMEN1NPC1GAA
SCHEMBL5778806 0.78 NOX1 (0.54) RAB9AKMT2AMEN1NPC1GAA
SCHEMBL5777191 0.78 PTK2 (0.44) RAB9AKMT2AMEN1NPC1GAA
SCHEMBL14742652 0.75 RAB9A (0.55) RAB9AKMT2AMEN1NPC1GAA
SCHEMBL5776228 0.75 RAB9A (0.55) RAB9AKMT2AMEN1NPC1GAA
SCHEMBL5776531 0.75 MAPT (0.61) RAB9AKMT2AMEN1NPC1GAA
Hydrochloric Acid SCHEMBL5778200 0.74 RAB9A (0.57) RAB9AKMT2AMEN1NPC1GAA
SCHEMBL5779129 0.74 PTK2 (0.39) RAB9AKMT2AMEN1NPC1GAA
SCHEMBL5774553 0.74 NPC1 (0.40) RAB9AKMT2AMEN1NPC1GAA

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 RAB9A 3127/4885KMT2A 3533/4885MEN1 3031/4885

“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.