SCHEMBL6541875

SCHEMBL6541875

Cc1ncc(CNC(=O)N(Cl)N=O)c(N)n1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.71
NFKB1 P19838 1/20 0.71
BLM P54132 1/20 0.71
PMP22 Q01453 1/20 0.71
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.36
TKT P29401 3/20 0.35

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
Nimustine SCHEMBL23301409 0.83 BLM (1.00) LMNANFKB1BLMPMP22CYP1A2
Nimustine SCHEMBL8414 0.83 BLM (1.00) LMNANFKB1BLMPMP22CYP1A2
Nimustine SCHEMBL98303 0.82 BLM (0.98) LMNANFKB1BLMPMP22CYP1A2
Nimustine SCHEMBL124427 0.82 BLM (0.98) LMNANFKB1BLMPMP22CYP1A2
Nimustine SCHEMBL1649545 0.82 BLM (0.98) LMNANFKB1BLMPMP22CYP1A2
Nimustine SCHEMBL1649348 0.81 BLM (0.96) LMNANFKB1BLMPMP22CYP1A2
SCHEMBL25299723 0.81 LMNA (0.79) LMNANFKB1BLMPMP22TKT
Nimustine SCHEMBL1580335 0.79 BLM (0.92) LMNANFKB1BLMPMP22CYP1A2
SCHEMBL15534393 0.79 LMNA (0.59) LMNANFKB1BLMPMP22ALDH1A1
SCHEMBL29594139 0.78 LMNA (0.57) LMNANFKB1BLMPMP22ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408909-A4 IMPROVED CONDITIONALLY REPLICATING VECTORS FOR INHIBITING VIRAL INFECTIONS VIRXSYS CORP (US) 2004-05-26 EP disclosed
EP-1408909-A2 IMPROVED CONDITIONALLY REPLICATING VECTORS FOR INHIBITING VIRAL INFECTIONS VIRxSYS Corporation (US) 2004-04-21 EP disclosed
EP-1356070-A2 CONDITIONALLY REPLICATING VIRAL VECTORS AND THEIR USE Virxsys (US) 2003-10-29 EP disclosed
WO-2002024897-A9 CONDITIONALLY REPLICATING VIRAL VECTORS AND THEIR USE VIRXSYS (US) 2003-03-20 WO disclosed
US-20030026791-A1 Conditionally replicating vectors for inhibiting viral infections VIRXSYS CORPORATION 2003-02-06 US disclosed
WO-2002078631-A2 IMPROVED CONDITIONALLY REPLICATING VECTORS FOR INHIBITING VIRAL INFECTIONS VIRXSYS (US) 2002-10-10 WO disclosed
WO-2002024897-A2 CONDITIONALLY REPLICATING VIRAL VECTORS AND THEIR USE VIRXSYS (US) 2002-03-28 WO disclosed