SCHEMBL5564413

SCHEMBL5564413

O=[N+]([O-])c1ccccc1Cn1nc(-c2ccc(CO)o2)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 11/20 0.64
ALDH1A1 P00352 3/20 0.64
LMNA P02545 3/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
HIF1A Q16665 2/20 0.64
EPAS1 Q99814 2/20 0.64
KDM4E B2RXH2 2/20 0.64
NPC1 O15118 1/20 0.64
GMNN O75496 1/20 0.64
TP53 P04637 1/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2D6 P10635 1/20 0.64
MAPT P10636 1/20 0.64
CYP2C9 P11712 1/20 0.64
HPGD P15428 1/20 0.64
ALOX15 P16050 1/20 0.64
NFKB1 P19838 1/20 0.64
MAPK1 P28482 1/20 0.64
CYP2C19 P33261 1/20 0.64

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
SCHEMBL3058590 0.83 ALDH1A1 (0.48) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL5564951 0.83 PDE5A (0.74) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL5565167 0.82 PDE5A (0.72) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL3071620 0.81 PDE5A (0.71) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL5564884 0.81 PDE5A (0.71) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL5560131 0.81 PDE5A (0.71) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL5566165 0.81 PDE5A (0.74) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL5564035 0.81 PDE5A (0.70) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL5565319 0.79 PDE5A (0.67) PDE5AALDH1A1LMNASMN1; SMN2HIF1A
SCHEMBL3076641 0.79 PDE5A (0.67) PDE5AALDH1A1LMNASMN1; SMN2HIF1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050187276-A1 Compounds, compositions and methods BIZBIOTECH CO., LTD. (KR) 2005-08-25 US claimed
US-7226941-B2 Compound for treating angiogenesis HIF BIO, INC. (US) 2007-06-05 US disclosed
US-20050187276-A1 Compounds, compositions and methods BIZBIOTECH CO., LTD. (KR) 2005-08-25 US 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-20050187276-A1 Compounds, compositions and methods HIF1A, HIF1AN, EGLN3 PDE5A 1987/4885ALDH1A1 858/4885LMNA 736/4885

“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.