SCHEMBL4954512

SCHEMBL4954512

O=[N+]([O-])C1(Cc2ccccc2)C=CC=NC1SC1N=CC=CC1(Cc1ccccc1)[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.36
CPA1 P15085 3/20 0.33

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
SCHEMBL3476384 0.70 HSD11B1 (0.33) HSD11B1
SCHEMBL7219338 0.69 MAPT (0.33) HSD11B1
SCHEMBL5273291 0.60 ALDH1A1 (0.36) CPA1
SCHEMBL20553211 0.60 MAOA (0.39) HSD11B1
SCHEMBL27818540 0.57 MAOA (0.38) HSD11B1
SCHEMBL8083733 0.57 MAPT (0.37) HSD11B1
SCHEMBL8765779 0.56 MC4R (0.37) HSD11B1
SCHEMBL7502415 0.56 ALDH1A1 (0.41) HSD11B1
SCHEMBL3957536 0.55
SCHEMBL11622221 0.54 ALDH1A1 (0.42) CPA1

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
US-7417021-B2 Biologically active conjugate of a biopolymer and therapeutic agent GENZYME CORPORATION (US) 2008-08-26 US disclosed
US-20040209842-A1 Modification of biopolymers for improved drug delivery GENZYME CORPORATION (US) 2004-10-21 US disclosed
US-6749865-B2 BIOLOGICALLY ACTIVE CONJUGATE OF A BIOPOLYMER AND A THERAPEUTIC AGENT JOINED BY A DISULFIDE BOND GENZYME CORPORATION 2004-06-15 US disclosed
US-20030087877-A1 Modification of biopolymers for improved drug delivery CENZYME CORPORATION 2003-05-08 US disclosed
EP-1263472-A2 MODIFICATION OF BIOPOLYMERS FOR IMPROVED DRUG DELIVERY GENZYME CORPORATION (US) 2002-12-11 EP disclosed
WO-2001060412-A2 MODIFICATION OF BIOPOLYMERS FOR IMPROVED DRUG DELIVERY GENZYME CORPORATION (US) 2001-08-23 WO 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 (2 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-20040209842-A1 Modification of biopolymers for improved drug delivery PTMS, PDIA6, SDCBP HSD11B1 4282/4885CPA1 1592/4885
US-20030087877-A1 Modification of biopolymers for improved drug delivery PTMS, PDIA6, SDCBP HSD11B1 4282/4885CPA1 1592/4885

“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.