SCHEMBL7815554

SCHEMBL7815554

NC(=O)N(O)Cc1ccc(Cc2cn(Cc3cccnc3)c3ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
HTR2C P28335 1/20 0.47
FNTA P49354 3/20 0.46
FNTB P49356 3/20 0.46
APP P05067 3/20 0.45
SNCA P37840 3/20 0.45
CHRM1 P11229 1/20 0.44
CYP19A1 P11511 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL7808063 0.82 HTR6 (0.50) HDAC1HDAC8HDAC6CNR1CNR2
SCHEMBL7809792 0.82 HDAC6 (0.62) HDAC1HDAC8HDAC6CNR1CNR2
SCHEMBL7809786 0.79 HDAC3 (0.50) CNR1CNR2HTR2CKDM4EHDAC3
SCHEMBL7809187 0.79 HDAC6 (0.58) HDAC1HDAC8HDAC6CNR1CNR2
SCHEMBL7803160 0.77 APP (0.56) HDAC1HDAC8HDAC6CNR1CNR2
SCHEMBL31370014 0.77 KMT2A (0.55) CNR1CNR2HTR2CFNTAFNTB
SCHEMBL17372069 0.77 HTR2C (0.62) CNR1CNR2HTR2CAPPSNCA
SCHEMBL7815558 0.76 LMNA (0.46) HDAC1HDAC8HDAC6CNR2HDAC3
SCHEMBL3852360 0.74 KMT2A (0.52) CNR1CNR2HTR2CFNTAFNTB
SCHEMBL9701802 0.74 HTR6 (0.64) HDAC1HDAC8HDAC6HDAC3ALDH1A1

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