SCHEMBL4209121

SCHEMBL4209121

Cc1nnnn1-c1ccccc1OCC(C)C

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
KCNN4 O15554 12/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
MAPK1 P28482 2/20 0.43
POU5F1 Q01860 1/20 0.39
TSHR P16473 1/20 0.38
CASP1 P29466 1/20 0.38
KMT2A Q03164 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
SCHEMBL4207470 0.84 ALDH1A1 (0.44) ALDH1A1KCNN4L3MBTL1MAPK1POU5F1
SCHEMBL4215375 0.84 MAPK1 (0.57) ALDH1A1KCNN4L3MBTL1MAPK1POU5F1
SCHEMBL4205385 0.83 ALDH1A1 (0.46) ALDH1A1KCNN4L3MBTL1MAPK1POU5F1
SCHEMBL4201412 0.81 ALDH1A1 (0.42) ALDH1A1KCNN4L3MBTL1MAPK1TSHR
SCHEMBL4203490 0.81 ALDH1A1 (0.44) ALDH1A1KCNN4L3MBTL1MAPK1POU5F1
SCHEMBL4205653 0.81 ALDH1A1 (0.51) ALDH1A1KCNN4MAPK1POU5F1TSHR
SCHEMBL4209251 0.81 KCNN4 (0.55) ALDH1A1KCNN4L3MBTL1TSHR
SCHEMBL4197401 0.80 ALDH1A1 (0.46) ALDH1A1KCNN4MAPK1POU5F1TSHR
SCHEMBL4196490 0.79 ALDH1A1 (0.40) ALDH1A1KCNN4L3MBTL1MAPK1TSHR
SCHEMBL4207402 0.79 KCNN4 (0.45) ALDH1A1KCNN4L3MBTL1MAPK1

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-7579480-B2 Alkoxy-(tetrazol-1-yl)benzaldehyde compound and process for producing the same TOYO KASEI KOGYO COMPANY LIMITED (JP) 2009-08-25 US disclosed
US-20070060630-A1 Alkoxy-(tetrazol-1-yl)benzaldehyde compound and process for producing the same TOYO KASEI KOGYO COMPANY LIMITED (JP) 2007-03-15 US disclosed
EP-1650198-A1 ALKOXYTETRAZOL-1-YLBENZALDEHYDE COMPOUND AND PROCESS FOR PRODUCING THE SAME Toyo Kasei Kogyo Company Limited (JP) 2006-04-26 EP 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-20070060630-A1 Alkoxy-(tetrazol-1-yl)benzaldehyde compound and process for producing the same ALDH7A1, NAT1, ARSA ALDH1A1 4/4885KCNN4 3193/4885L3MBTL1 1846/4885

“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.