SCHEMBL12469267

SCHEMBL12469267

C=C1OB(c2ccccc2NC(=O)OC(C)(C)C)OC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 1/20 0.38
RXFP1 Q9HBX9 1/20 0.36
METAP1 P53582 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
LIPE Q05469 6/20 0.36
BRD4 O60885 1/20 0.34
MAPK10 P53779 1/20 0.34
AAK1 Q2M2I8 1/20 0.34
TDP2 O95551 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL13413127 0.84 ALDH1A1 (0.41) RXFP1LMNAPOLBLIPEMEN1
SCHEMBL14560 0.83 LIPE (0.48) BRD9RXFP1METAP1LMNAPOLB
SCHEMBL90904 0.79 AAK1 (0.39) BRD9POLBAAK1MEN1KMT2A
SCHEMBL879085 0.77 AAK1 (0.38) AAK1GAA
SCHEMBL13451308 0.75 CA12 (0.33) LMNABRD4TDP2MEN1GAA
SCHEMBL12888644 0.74 TSHR (0.36) METAP1AAK1
SCHEMBL3712015 0.72 AAK1 (0.42) BRD9RXFP1METAP1LMNAPOLB
SCHEMBL12316014 0.72 NAMPT (0.39) AAK1
SCHEMBL2880191 0.72 LMNA (0.54) BRD9RXFP1METAP1LMNAPOLB
SCHEMBL29984550 0.71 AAK1 (0.41) BRD9RXFP1METAP1LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-07-28 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-20110182812-A1 Imaging Agents for Detecting Neurological Disorders MAPT, APP, PSEN1 BRD9 4415/4885RXFP1 1027/4885METAP1 623/4885

“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.