SCHEMBL4227934

SCHEMBL4227934

CC(C)(Cc1ccc(Oc2ccc([N+](=O)[O-])cc2)c(F)c1)OC(N)=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 3/20 0.53
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PDE7A Q13946 1/20 0.40
TDP2 O95551 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
TBXA2R P21731 5/20 0.39
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL4240320 0.88 ALDH1A1 (0.42) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL4233545 0.88 TDP2 (0.47) ALDH1A1MAPTMEN1KMT2ATDP2
SCHEMBL4236941 0.88 HSPB1 (0.40) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL4237809 0.87 PDE7A (0.54) ALDH1A1MAPTMEN1KMT2APDE7A
SCHEMBL4237489 0.87 TBXA2R (0.41) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL4238971 0.87 TTR (0.48) ALDH1A1MAPTMEN1KMT2ATDP2
SCHEMBL4232035 0.85 MAPT (0.46) ALDH1A1MAPTMEN1KMT2ATBXA2R
SCHEMBL4238193 0.85 MEN1 (0.46) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL4238047 0.85 TBXA2R (0.48) ALDH1A1MAPTMEN1KMT2APDE7A
SCHEMBL4237866 0.85 MAOB (0.40) HSPB1ALDH1A1MAPTMEN1KMT2A

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 4542/4885MAPT 1398/4885

“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.