SCHEMBL5776255

SCHEMBL5776255

NNc1ccc(-c2cnco2)cc1I

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
MAP4K4 O95819 1/20 0.47
LMNA P02545 2/20 0.45
PKM P14618 2/20 0.45
NOTUM Q6P988 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
AAK1 Q2M2I8 4/20 0.43
PTK2 Q05397 1/20 0.43
KEAP1 Q14145 1/20 0.41
LTA4H P09960 1/20 0.39
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37

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
SCHEMBL5777042 0.79 MAP4K4 (0.56) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL17965571 0.78 TTK (0.49) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL14561709 0.76 NOTUM (0.53) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL5776148 0.74 RAB9A (0.45) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL5776770 0.73 PKM (0.58) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL31421202 0.72 GAA (0.53) CYP11B1CYP11B2MAP4K4LMNAPKM
Hydrochloric Acid SCHEMBL5776713 0.71 PKM (0.56) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL13151143 0.71 MAP4K4 (0.68) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL10768177 0.71 PKM (0.78) CYP11B1CYP11B2MAP4K4LMNAPKM
SCHEMBL26260196 0.70 CYP11B1 (0.85) CYP11B1CYP11B2MAP4K4LMNAPKM

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 CYP11B1 604/4885CYP11B2 800/4885MAP4K4 4009/4885

“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.