SCHEMBL9436102

SCHEMBL9436102

O=CNNC(=O)CBr

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL23475924 0.76 TSHR (0.44)
SCHEMBL2447138 0.72
SCHEMBL18470774 0.72
SCHEMBL16015581 0.70
SCHEMBL23735557 0.67 NPSR1 (0.38)
SCHEMBL31478239 0.67
SCHEMBL16807522 0.67
SCHEMBL23987888 0.66 HSP90AA1 (0.52)
SCHEMBL23988250 0.66 HDAC3 (0.34)
SCHEMBL182913 0.65

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
US-5374516-A Covalently attached to polymer particles of ethylenically unsaturated monomers with reactive alkylsulfonyl or halogen groups; detecting hormones, drugs, steroids in urine, blood, saliva EASTMAN KODAK COMPANY (US) 1994-12-20 US disclosed
EP-0302715-B1 AVIDIN- AND BIOTIN-IMMOBILIZED REAGENTS, ANALYTICAL ELEMENTS AND METHODS OF USE EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1992-04-22 EP disclosed
EP-0370694-A2 Diagnostic kit and method using a solid phase capture means for detecting nucleic acids EASTMAN KODAK COMPANY (US) 1990-05-30 EP disclosed
EP-0302715-A1 Avidin- and biotin-immobilized reagents, analytical elements and methods of use EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-02-08 EP disclosed