SCHEMBL4203255

SCHEMBL4203255

CC(C)(C)Oc1ccccc1-n1cnnn1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ NOTUM Q6P988 2/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ TSHR P16473 1/20 0.44
▸ NPC1 O15118 1/20 0.40
▸ MARS1 P56192 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL28188345 0.84 ALDH1A1 (0.49) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL2721346 0.81 ALDH1A1 (0.64) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL4202205 0.77 ALDH1A1 (0.51) ALDH1A1NPSR1TSHRLMNAKDM4E
SCHEMBL4205521 0.77 ALDH1A1 (0.49) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL12615992 0.76 ALDH1A1 (0.68) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL27941623 0.75 ALDH1A1 (0.54) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL4210503 0.75 ALDH1A1 (0.46) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL4197409 0.75 XDH (0.48) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL2199051 0.74 ALDH1A1 (0.49) ALDH1A1NPSR1NOTUMKMT2ATSHR
SCHEMBL4207326 0.74 ALDH1A1 (0.45) ALDH1A1NPSR1NOTUMKMT2ATSHR

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 4/4885NPSR1 2735/4885NOTUM 1223/4885

“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.

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