SCHEMBL7808063

SCHEMBL7808063

NC(=O)N(O)CCn1cc(Cc2cccnc2)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.50
CNR2 P34972 2/20 0.45
TBXAS1 P24557 2/20 0.45
HDAC3 O15379 1/20 0.43
CNR1 P21554 1/20 0.42
HTR2C P28335 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ICMT O60725 1/20 0.39
RECQL P46063 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
SCHEMBL7809786 0.92 HDAC3 (0.50) HTR6CNR2TBXAS1HDAC3CNR1
SCHEMBL9701802 0.88 HTR6 (0.64) HTR6HDAC3LMNAHDAC1HDAC8
SCHEMBL7815554 0.82 HDAC1 (0.49) HTR6CNR2HDAC3CNR1HTR2C
SCHEMBL7811888 0.81 CAMK2D (0.51) CNR2TBXAS1CNR1
SCHEMBL7809789 0.80 TBXAS1 (0.51) TBXAS1HDAC3HDAC1HDAC8HDAC6
SCHEMBL7803155 0.74 CAMK2D (0.52) CNR2TBXAS1CNR1ICMT
SCHEMBL7809792 0.72 HDAC6 (0.62) CNR2HDAC3CNR1HTR2CLMNA
SCHEMBL7803160 0.71 APP (0.56) CNR2HDAC3CNR1HTR2CKDM4E
SCHEMBL31370014 0.70 KMT2A (0.55) CNR2CNR1HTR2CKDM4ELMNA
SCHEMBL8544039 0.69 TBXAS1 (0.52) HTR6CNR2TBXAS1HDAC3CNR1

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