SCHEMBL15216487

SCHEMBL15216487

Cc1cccc(/C=[N+](\[O-])C(C)(C)C)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.50
TDP1 Q9NUW8 2/20 0.47
TP53 P04637 1/20 0.47
NPC1 O15118 2/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ACHE P22303 2/20 0.40
TSHR P16473 1/20 0.40
ALOX5 P09917 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
RELA Q04206 1/20 0.39
HSP90AA1 P07900 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
CYP1A2 P05177 1/20 0.37
NFE2L2 Q16236 1/20 0.36
MAOA P21397 1/20 0.35

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
SCHEMBL28566965 1.00 FBP1 (0.50) FBP1TDP1TP53NPC1CASP3
SCHEMBL7922822 0.80 FBP1 (0.49) FBP1TDP1NPC1PTGS1PTGS2
SCHEMBL15216495 0.80 FBP1 (0.49) FBP1TDP1NPC1PTGS1PTGS2
SCHEMBL4711176 0.80 FBP1 (0.49) FBP1TDP1TSHRMAOAMAOB
SCHEMBL15216509 0.80 FBP1 (0.49) FBP1TDP1NPC1RELAHSP90AA1
SCHEMBL6260317 0.78 TDP1 (0.59) FBP1TDP1TSHRALDH1A1MAPT
SCHEMBL267779 0.78 TDP1 (0.59) FBP1TDP1TSHRALDH1A1MAPT
SCHEMBL244830 0.78 TDP1 (0.59) FBP1TDP1TSHRALDH1A1MAPT
SCHEMBL15216488 0.77 ALDH1A1 (0.38) TDP1TP53CYP1A2ALDH1A1MAPT
SCHEMBL15216519 0.77 NFE2L2 (0.56) FBP1NPC1ACHETSHRRAB9A

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-20130225694-A1 COMPOSITIONS AND METHODS OF INHIBITING RETINAL DEGENERATION OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2013-08-29 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-20130225694-A1 COMPOSITIONS AND METHODS OF INHIBITING RETINAL DEGENERATION ALDH1A2, PDE6C, NQO1 FBP1 668/4885TDP1 588/4885TP53 3887/4885

“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.