SCHEMBL5777785

SCHEMBL5777785

Fc1ccc(C=NNc2ccc(-c3cnco3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 3/20 0.50
KCNH2 Q12809 1/20 0.50
RAB9A P51151 7/20 0.46
NPC1 O15118 6/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPK1 P28482 2/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
GAA P10253 4/20 0.42
PKM P14618 3/20 0.42
LMNA P02545 2/20 0.42
NOTUM Q6P988 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
PTK2 Q05397 1/20 0.41
POLB P06746 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 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
SCHEMBL5777782 1.00 MPO (0.50) MPOKCNH2RAB9ANPC1ALDH1A1
SCHEMBL5779703 0.87 GAA (0.42) KCNH2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL5779271 0.87 NPC1 (0.47) RAB9ANPC1ALDH1A1KDM4EGAA
SCHEMBL5779274 0.87 NPC1 (0.47) RAB9ANPC1ALDH1A1KDM4EGAA
SCHEMBL5779700 0.87 GAA (0.42) KCNH2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL14742652 0.86 RAB9A (0.55) RAB9ANPC1ALDH1A1KDM4ETDP1
SCHEMBL5776228 0.86 RAB9A (0.55) RAB9ANPC1ALDH1A1KDM4ETDP1
SCHEMBL5778806 0.86 NOX1 (0.54) RAB9ANPC1ALDH1A1MAPK1KDM4E
SCHEMBL5778811 0.86 NOX1 (0.54) RAB9ANPC1ALDH1A1MAPK1KDM4E
SCHEMBL5777539 0.86 LMNA (0.39) MPOKCNH2RAB9ANPC1ALDH1A1

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 MPO 2642/4885KCNH2 1786/4885RAB9A 3127/4885

“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.