SCHEMBL4205659

SCHEMBL4205659

COc1cccc(-n2nnnc2C(C)C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.59
LMNA P02545 6/20 0.59
RAB9A P51151 5/20 0.59
NPSR1 Q6W5P4 4/20 0.59
MAPT P10636 4/20 0.59
HPGD P15428 3/20 0.59
KMT2A Q03164 3/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
S1PR4 O95977 2/20 0.59
S1PR1 P21453 2/20 0.59
HTT P42858 2/20 0.59
NPC1 O15118 2/20 0.56
HSD17B10 Q99714 2/20 0.53
MAPK1 P28482 2/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 6/20 0.51
PKM P14618 1/20 0.46
NOTUM Q6P988 1/20 0.44
MEN1 O00255 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL4201310 0.87 NPSR1 (0.50) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4215356 0.84 ALDH1A1 (0.43) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4199101 0.84 ALDH1A1 (0.58) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4198991 0.83 ALDH1A1 (0.45) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4203933 0.83 ALDH1A1 (0.53) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4209746 0.82 ALDH1A1 (0.43) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4208584 0.82 ALDH1A1 (0.50) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4205775 0.81 ALDH1A1 (0.49) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4213757 0.80 ALDH1A1 (0.64) ALDH1A1LMNARAB9ANPSR1MAPT
SCHEMBL4406688 0.79 NPSR1 (0.57) ALDH1A1LMNARAB9ANPSR1MAPT

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 4/4885LMNA 2434/4885RAB9A 4394/4885

“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.