SCHEMBL4229236

SCHEMBL4229236

CCC(CC)NC(=O)Nc1ccc(Oc2ccc([N+](=O)[O-])cc2C)c(COC)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 0.44
MEN1 O00255 11/20 0.44
MAPT P10636 10/20 0.44
MAPK1 P28482 5/20 0.44
POLB P06746 4/20 0.44
BLM P54132 1/20 0.44
PKM P14618 1/20 0.42
LMNA P02545 4/20 0.40
ALDH1A1 P00352 3/20 0.40
HTT P42858 2/20 0.40
GNRHR P30968 1/20 0.40
TBXA2R P21731 1/20 0.40
NPSR1 Q6W5P4 2/20 0.39
MYOC Q99972 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 1/20 0.38
XBP1 P17861 1/20 0.38
RAB9A P51151 1/20 0.38
CCR6 P51684 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
SCHEMBL4242559 0.89 PKM (0.49) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4235514 0.87 MEN1 (0.56) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4690578 0.86 MEN1 (0.45) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4690577 0.86 MEN1 (0.45) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4242160 0.84 PKM (0.46) KMT2AMEN1MAPTPKMALDH1A1
SCHEMBL4236591 0.84 PKM (0.53) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4233910 0.82 MEN1 (0.54) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4227907 0.82 MEN1 (0.55) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4233889 0.80 KMT2A (0.52) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4687741 0.78 PKM (0.56) KMT2AMEN1MAPTMAPK1POLB

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 KMT2A 3436/4885MEN1 2447/4885MAPT 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.