SCHEMBL6935626

SCHEMBL6935626

Cc1nn(C)c(NCCC2CNCCN2)c1N

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 1/20 0.30

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
SCHEMBL6934679 0.82 CYP1A2 (0.37)
SCHEMBL6934565 0.74 KDM4E (0.35)
SCHEMBL6935623 0.71
Hydrochloric Acid SCHEMBL7110990 0.69 GAA (0.33)
SCHEMBL5228462 0.66 KDM4E (0.34)
SCHEMBL6934682 0.66 NMT1 (0.42)
SCHEMBL6937423 0.65 NPC1 (0.44)
SCHEMBL2918261 0.65 CXCR4 (0.36) CXCR4
SCHEMBL16830372 0.64 CXCR4 (0.38) CXCR4
SCHEMBL6934711 0.62 SMN1; SMN2 (0.37)

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-1304995-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2003-05-02 EP claimed
WO-2002009662-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-02-07 WO claimed
EP-1304995-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2003-05-02 EP disclosed
WO-2002009662-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-02-07 WO disclosed