SCHEMBL19682135

SCHEMBL19682135

Nc1ccc2c(c1)C(CO)c1cc(NC3CCC3)ccc1-2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.34
EPHX1 P07099 1/20 0.34
RAB9A P51151 1/20 0.34
BACE1 P56817 2/20 0.32
BACE2 Q9Y5Z0 2/20 0.32
MAPT P10636 2/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
APAF1 O14727 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ROCK2 O75116 2/20 0.32
CCR2 P41597 2/20 0.32
ROCK1 Q13464 2/20 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
SCHEMBL29844508 0.79 CDK5 (0.37) GAARAB9AMAPTKDM4EMEN1
SCHEMBL29844446 0.79 CDK5 (0.37) GAARAB9AMAPTKDM4EMEN1
SCHEMBL275596 0.79 CDK5 (0.37) GAARAB9AMAPTKDM4EMEN1
SCHEMBL12009751 0.79
SCHEMBL19682115 0.78 GAA (0.34) GAAEPHX1RAB9ABACE1BACE2
Hydrochloric Acid SCHEMBL1114916 0.77 CDK5 (0.36) GAARAB9AMAPTKDM4EMEN1
Hydrochloric Acid SCHEMBL27734241 0.77 CDK5 (0.36) GAARAB9AMAPTKDM4EMEN1
SCHEMBL1230997 0.71 HTR2A (0.47) RAB9AMAPTKDM4EMEN1APAF1
SCHEMBL29844647 0.71 HTR2A (0.47) RAB9AMAPTKDM4EMEN1APAF1
SCHEMBL14327287 0.70 ALDH1A1 (0.36) GAARAB9ABACE1MAPTKDM4E

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-20170348426-A1 COMPOSITION COMPRISING A POLYMERIC REAGENT NEKTAR THERAPEUTICS 2017-12-07 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-20170348426-A1 COMPOSITION COMPRISING A POLYMERIC REAGENT CD44, FCGRT, C9 GAA 613/4885EPHX1 985/4885RAB9A 3754/4885

“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.