SCHEMBL4201410

SCHEMBL4201410

CC(C)(C)Oc1ccccc1-n1nnnc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 11/20 0.41
ALDH1A1 P00352 4/20 0.40
MAPT P10636 2/20 0.39
HTT P42858 2/20 0.39
HPGD P15428 1/20 0.39
CCR6 P51684 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
P2RX7 Q99572 1/20 0.38
TACR1 P25103 1/20 0.37
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SCN9A Q15858 1/20 0.35
MAPK1 P28482 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
SCHEMBL4216678 0.89 KCNN4 (0.40) KCNN4ALDH1A1MAPTHTTHPGD
SCHEMBL4205517 0.85 KCNN4 (0.56) KCNN4ALDH1A1MAPTHTTHPGD
SCHEMBL4209716 0.82 KCNN4 (0.51) KCNN4ALDH1A1P2RX7TACR1
SCHEMBL4205786 0.82 MAPK1 (0.53) KCNN4ALDH1A1HPGDP2RX7LMNA
SCHEMBL4209120 0.81 KCNN4 (0.47) KCNN4ALDH1A1MAPTHTTLMNA
SCHEMBL4197400 0.80 ALDH1A1 (0.47) KCNN4ALDH1A1HPGDLMNATSHR
SCHEMBL4205401 0.79 MAPK1 (0.42) KCNN4ALDH1A1TSHRMAPK1
SCHEMBL4201412 0.79 ALDH1A1 (0.42) KCNN4ALDH1A1TACR1TSHRMAPK1
SCHEMBL4205543 0.78 KCNN4 (0.42) KCNN4ALDH1A1P2RX7TACR1MAPK1
SCHEMBL4207466 0.77 KCNN4 (0.41) KCNN4ALDH1A1MAPTHTTP2RX7

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 KCNN4 3193/4885ALDH1A1 4/4885MAPT 3279/4885

“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.