SCHEMBL18346604

SCHEMBL18346604

CC(=O)OCC1OC(OC(=N)C(Cl)(Cl)Cl)C(N=[N+]=[N-])[C@@H](C)[C@@H]1O[C@@H]1OC(Cc2ccccc2)[C@@H](C)[C@@H](OCc2ccccc2)C1C

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
LMNA P02545 2/20 0.35
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.33
NT5E P21589 1/20 0.32
FGF1 P05230 2/20 0.30
FGF2 P09038 2/20 0.30
VEGFA P15692 2/20 0.30
HPSE Q9Y251 2/20 0.30
PRKCA P17252 1/20 0.30
AKT1 P31749 1/20 0.30
PTK2 Q05397 1/20 0.30

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
SCHEMBL18346652 0.94 CYP2D6 (0.36) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL16656541 0.94 CYP2D6 (0.36) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL16656565 0.92 CYP2D6 (0.35) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL16656564 0.92 CYP2D6 (0.35) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL18346734 0.91 LMNA (0.42) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL17635136 0.89 CYP2D6 (0.40) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL16418339 0.87 LMNA (0.35) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL18346615 0.86 CYP2D6 (0.37) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL28630801 0.86 CYP2D6 (0.41) CYP2D6ALDH1A1MAPK1LMNAKMT2A
SCHEMBL14363005 0.86 CYP2D6 (0.41) CYP2D6ALDH1A1MAPK1LMNAKMT2A

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-9527930-B2 FGF receptor-activating N-sulfate oligosaccharides, preparation thereof, and therapeutic use thereof SANOFI (FR) 2016-12-27 US disclosed
US-20120202769-A1 FGF RECEPTOR-ACTIVATING N-SULFATE OLIGOSACCHARIDES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-08-09 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-20120202769-A1 FGF RECEPTOR-ACTIVATING N-SULFATE OLIGOSACCHARIDES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF FGFR1, FGF1, FGF2 CYP2D6 2659/4885ALDH1A1 1496/4885MAPK1 669/4885

“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.