SCHEMBL7803155

SCHEMBL7803155

NC(=O)N(O)CCCCCCn1cc(-c2cccnc2)c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 4/20 0.52
KDR P35968 2/20 0.43
TBXAS1 P24557 2/20 0.42
ASH1L Q9NR48 3/20 0.42
ICMT O60725 2/20 0.41
GSK3B P49841 3/20 0.39
CNR2 P34972 2/20 0.39
TLR8 Q9NR97 1/20 0.39
QPCT Q16769 2/20 0.39
IDH1 O75874 1/20 0.39
CNR1 P21554 1/20 0.39

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
SCHEMBL7811888 0.91 CAMK2D (0.51) CAMK2DKDRTBXAS1ASH1LGSK3B
SCHEMBL7809786 0.83 HDAC3 (0.50) CAMK2DTBXAS1ICMTCNR2CNR1
SCHEMBL7803168 0.79 TBXAS1 (0.54) TBXAS1
SCHEMBL7803002 0.79 TBXAS1 (0.70) TBXAS1
SCHEMBL7803024 0.78 TBXAS1 (0.53) TBXAS1
SCHEMBL7803269 0.76 ALDH1A1 (0.45) TBXAS1CNR2
SCHEMBL7809757 0.76 ALDH1A1 (0.45) TBXAS1CNR2
SCHEMBL7811305 0.76 ALDH1A1 (0.45) TBXAS1CNR2
SCHEMBL7811788 0.76 ALDH1A1 (0.45) TBXAS1CNR2
SCHEMBL7815552 0.75 ALDH1A1 (0.46) TBXAS1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0949259-B1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2001-06-20 EP disclosed
US-6184238-B1 ANTIALLERGENS, ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-02-06 US disclosed
EP-0949259-A1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-10-13 EP disclosed