SCHEMBL7809796

SCHEMBL7809796

O=C(O)c1ccc(Cc2cc3ccccc3n2Cc2cccnc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
CCR2 P41597 2/20 0.47
CNR2 P34972 1/20 0.45
TP53 P04637 1/20 0.45
IDO1 P14902 1/20 0.45
PLA2G10 O15496 1/20 0.45
GAA P10253 1/20 0.45
THRB P10828 1/20 0.44
PPARG P37231 1/20 0.43

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
SCHEMBL7809191 0.87 TP53 (0.52) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL7815558 0.82 LMNA (0.46) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL7423858 0.80 CCR2 (0.74) LMNACCR2CNR2IDO1PLA2G10
SCHEMBL7811881 0.77 LMNA (0.49) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL7803181 0.76 LMNA (0.52) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL11067952 0.75 TBXAS1 (0.67) GAATBXAS1
SCHEMBL30229394 0.73 GABRA5 (0.48) LMNACCR2CNR2IDO1GAA
SCHEMBL18247693 0.73 GABRA5 (0.48) LMNACCR2CNR2IDO1GAA
Hydrochloric Acid SCHEMBL11062270 0.73 TBXAS1 (0.68) GAATBXAS1
SCHEMBL7809792 0.73 HDAC6 (0.62) LMNAHDAC3HDAC1HDAC10HDAC8

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