SCHEMBL4242219

SCHEMBL4242219

COc1c[c]ccc1Oc1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
MAPK1 P28482 3/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TDP1 Q9NUW8 4/20 0.45
CYP3A4 P08684 2/20 0.44
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
TEAD4 Q15561 1/20 0.41
MAPT P10636 4/20 0.40
POLB P06746 1/20 0.40
MAOA P21397 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
NR4A1 P22736 1/20 0.38
APP P05067 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
MAOB P27338 1/20 0.37

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
SCHEMBL5583633 0.84 AR (0.51) ALDH1A1MAPK1HTTL3MBTL1TDP1
SCHEMBL11653814 0.83 L3MBTL1 (0.46) ALDH1A1MAPK1HTTL3MBTL1SMN1; SMN2
SCHEMBL5448722 0.82 ALDH1A1 (0.53) ALDH1A1MAPK1HTTL3MBTL1TSHR
SCHEMBL8674 0.77 CA2 (0.46) ALDH1A1MAPK1HTTL3MBTL1TDP1
SCHEMBL29553492 0.76 ALDH1A1 (0.79) ALDH1A1MAPK1HTTL3MBTL1TDP1
SCHEMBL553790 0.76 ALDH1A1 (0.79) ALDH1A1MAPK1HTTL3MBTL1TDP1
SCHEMBL10354935 0.75 PTPRZ1 (0.39) ALDH1A1MAPK1HTTL3MBTL1TDP1
SCHEMBL6305394 0.75 ALDH1A1 (0.53) ALDH1A1MAPK1HTTL3MBTL1TSHR
SCHEMBL28251730 0.75 CA2 (0.43) ALDH1A1MAPK1HTTL3MBTL1TDP1
SCHEMBL27494520 0.75 CA2 (0.43) ALDH1A1MAPK1HTTL3MBTL1TDP1

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 3 patents. 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
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO 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 ALDH1A1 4542/4885MAPK1 1312/4885HTT 618/4885

“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.