SCHEMBL5718646

SCHEMBL5718646

C[Si](C)(C)CCCNc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.64
GLA P06280 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
MAPT P10636 14/20 0.59
KDM4E B2RXH2 2/20 0.59
HPGD P15428 1/20 0.57
ALOX12 P18054 1/20 0.57
GAA P10253 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
PKM P14618 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
RECQL P46063 1/20 0.49
HSD17B10 Q99714 1/20 0.49

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
SCHEMBL4951837 0.84 ALDH1A1 (0.73) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL13902545 0.84 ALDH1A1 (0.57) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL18549022 0.83 ALDH1A1 (0.66) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL14117517 0.83 ALDH1A1 (0.66) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL9651956 0.81 MAPT (0.68) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL22609165 0.81 ALDH1A1 (0.57) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL9003269 0.80 MAPT (0.70) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL1046139 0.80 MAPT (0.66) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL5718653 0.80 MAPT (0.65) ALDH1A1GLASMN1; SMN2MAPTKDM4E
SCHEMBL3476585 0.79 MAPT (0.64) ALDH1A1GLASMN1; SMN2MAPTKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1298135-B1 Dyeing composition containing silyl substituted p-aminophenol or p-phenylenediamine OREAL (FR) 2006-08-16 EP disclosed
US-7018427-B2 Dyeing composition containing a para-aminophenol or para-phenylenediamine compound substituted with a silane radical L'OREAL S.A. (FR) 2006-03-28 US disclosed
US-20030150066-A1 Dyeing composition containing a para-aminophenol or para-phenylenediamine compound substituted with a silane radical L'OREAL S.A. (FR) 2003-08-14 US disclosed
EP-1298135-A1 Dyeing composition containing silyl substituted p-aminophenol or p-phenylenediamine L'OREAL (FR) 2003-04-02 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-20030150066-A1 Dyeing composition containing a para-aminophenol or para-phenylenediamine compound substituted with a silane radical KRT18, CDC73, S100P ALDH1A1 161/4885GLA 1606/4885SMN1; SMN2 3911/4885

“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.