SCHEMBL6099427

SCHEMBL6099427

C=CCn1cc(C2=CC(=O)NC2=O)c2cc(O)ccc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GSK3B P49841 1/20 0.38
CNR2 P34972 2/20 0.37
WEE1 P30291 8/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 1/20 0.33
PDE4B Q07343 2/20 0.33
PDE4D Q08499 1/20 0.33
NTRK1 P04629 1/20 0.32
NTRK3 Q16288 1/20 0.32
NTRK2 Q16620 1/20 0.32
CHEK1 O14757 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL6099982 0.83 PDE4B (0.51) GSK3BCNR2ALDH1A1HPGDPDE4B
SCHEMBL6096942 0.70 L3MBTL1 (0.45)
SCHEMBL28101377 0.69 CDK4 (0.43) GSK3B
SCHEMBL9325503 0.68 PLA2G2A (0.42) CNR2
SCHEMBL19751957 0.68 GSK3B (0.50) GSK3BCNR2
SCHEMBL6098592 0.67 PPARD (0.48) ALDH1A1
SCHEMBL5879151 0.66 BRAF (0.44) WEE1ALDH1A1HPGDNTRK1CHEK1
SCHEMBL2954257 0.64 GSK3B (0.43) MEN1KMT2AGSK3B
SCHEMBL28656304 0.64 CCNT1 (0.48) MEN1KMT2ACNR2
SCHEMBL11825251 0.64 MAPT (0.47) MEN1KMT2AALDH1A1

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-7129250-B2 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2006-10-31 US disclosed
US-20040220202-A1 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2004-11-04 US disclosed
US-20040102467-A1 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2004-05-27 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 (2 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-20040220202-A1 Neuroprotective and anti-proliferative compounds NLN, MKI67, BDNF MEN1 3197/4885KMT2A 3903/4885GSK3B 388/4885
US-20040102467-A1 Neuroprotective and anti-proliferative compounds MKI67, NLN, BDNF MEN1 3337/4885KMT2A 3945/4885GSK3B 371/4885

“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.