SCHEMBL15062366

SCHEMBL15062366

O=C(O)c1ccc(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.64
LMNA P02545 1/20 0.63
TDP1 Q9NUW8 1/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
TSHR P16473 3/20 0.58
TP53 P04637 2/20 0.57
TTR P02766 1/20 0.57
SRD5A2 P31213 1/20 0.54
HCAR3 P49019 5/20 0.54
CA12 O43570 1/20 0.54
CA9 Q16790 1/20 0.54
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GPR35 Q9HC97 1/20 0.51
CYP1A2 P05177 1/20 0.51
CES2 O00748 1/20 0.51
MAPT P10636 1/20 0.50

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
SCHEMBL11195885 0.91 CASP6 (0.75) CASP6LMNATSHRHCAR3
SCHEMBL11781006 0.87 TDP1 (0.61) CASP6LMNATDP1MEN1KMT2A
SCHEMBL20591997 0.87 TP53 (0.51) CASP6LMNATDP1MEN1KMT2A
SCHEMBL5958796 0.84 TDP1 (0.65) LMNATDP1MEN1KMT2ATSHR
SCHEMBL17197945 0.83 CASP6 (0.68) CASP6LMNATSHRHCAR3
Hydrochloric Acid SCHEMBL9784149 0.82 CASP6 (0.62) CASP6LMNATDP1TSHRTTR
SCHEMBL9557826 0.81 CASP6 (0.66) CASP6LMNATDP1TSHRHCAR3
SCHEMBL23499234 0.80 CASP6 (0.64) CASP6LMNATDP1TSHRHCAR3
SCHEMBL31548567 0.80 CASP6 (0.64) CASP6LMNAMEN1KMT2ATSHR
SCHEMBL30011381 0.80 CASP6 (0.64) CASP6LMNATDP1TSHRHCAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2797946-B1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2016-05-04 EP disclosed
US-9260467-B2 Sialic acid dimers BROSSMER REINHARD (DE) 2016-02-16 US disclosed
US-20150005245-A1 Sialic Acid Dimers BROSSMER REINHARD (DE) 2015-01-01 US disclosed
EP-2797946-A1 SIALIC ACID DIMERS Brossmer, Reinhard (DE) 2014-11-05 EP disclosed
WO-2013097942-A1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2013-07-04 WO disclosed
EP-2610263-A1 Sialic acid dimers Brossmer, Reinhard (DE) 2013-07-03 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-20150005245-A1 Sialic Acid Dimers SIGLEC9, SIGLEC7, NEU2 CASP6 1945/4885LMNA 924/4885TDP1 4267/4885

“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.