SCHEMBL4232011

SCHEMBL4232011

CC(C)(Cc1ccc(Oc2ccc([N+](=O)[O-])cc2O)cc1F)OC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 2/20 0.39
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
PDE7A Q13946 1/20 0.38
TBXA2R P21731 8/20 0.36
GAA P10253 2/20 0.36
PKM P14618 1/20 0.36
TTR P02766 1/20 0.35
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL4238402 0.90 TBXA2R (0.39) HSPB1ALDH1A1MEN1KMT2AMAPT
SCHEMBL4242192 0.89 PDE7A (0.52) ALDH1A1MEN1KMT2AMAPTPDE7A
SCHEMBL4237839 0.88 ALDH1A1 (0.44) HSPB1ALDH1A1MEN1KMT2AMAPT
SCHEMBL4229107 0.88 TBXA2R (0.42) HSPB1ALDH1A1MEN1KMT2AMAPT
SCHEMBL4236908 0.86 HSPB1 (0.43) HSPB1ALDH1A1MEN1KMT2AMAPT
SCHEMBL4236443 0.84 CHRNB2 (0.39) HSPB1ALDH1A1MEN1KMT2AMAPT
SCHEMBL4232519 0.81 TDP1 (0.37) ALDH1A1MEN1KMT2AMAPTTTR
SCHEMBL4240198 0.78 MAPT (0.44) HSPB1ALDH1A1MEN1KMT2AMAPT
SCHEMBL4227934 0.78 HSPB1 (0.53) HSPB1ALDH1A1MEN1KMT2AMAPT
SCHEMBL28381891 0.77 PDE7A (0.43) ALDH1A1MEN1KMT2AMAPTPDE7A

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R HSPB1 3146/4885ALDH1A1 4542/4885MEN1 2447/4885

“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.