SCHEMBL8479142

SCHEMBL8479142

O=C(NCCCCCCNC(=O)c1ccc2cc(O)c(O)cc2c1)c1ccc2cc(O)c(O)cc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 6/20 0.64
▸ HDAC1 Q13547 6/20 0.64
▸ HDAC4 P56524 5/20 0.64
▸ HDAC7 Q8WUI4 5/20 0.64
▸ HDAC2 Q92769 5/20 0.64
▸ HDAC10 Q969S8 5/20 0.64
▸ HDAC11 Q96DB2 5/20 0.64
▸ HDAC8 Q9BY41 5/20 0.64
▸ HDAC6 Q9UBN7 5/20 0.64
▸ HDAC9 Q9UKV0 5/20 0.64
▸ HDAC5 Q9UQL6 5/20 0.64
▸ XDH P47989 1/20 0.60
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ LCK P06239 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ DRD2 P14416 1/20 0.51
▸ ADRA1A P35348 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ NR1H4 Q96RI1 1/20 0.48

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
SCHEMBL7157450 0.85 NAAA (0.60) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL18619400 0.84 HDAC6 (0.58) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL5694739 0.83 NAAA (0.53) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL14599479 0.83 NAAA (0.53) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL5539564 0.83 NAAA (0.53) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL5709554 0.82 NAAA (0.53) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL5694756 0.81 APP (0.53) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL5709548 0.81 APP (0.53) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL5543338 0.81 APP (0.53) HDAC3HDAC1HDAC4HDAC7HDAC2
SCHEMBL31047577 0.80 NAAA (0.62) HDAC3HDAC1HDAC4HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6005085-A NOVEL CONDENSED AZO COMPOUNDS USING BISAMIDE COMPOUNDS OF 2-HYDROXYNAPHTHALENE-3,6-DICARBOXYLIC ACID, AMIDE, OR ESTER AS THE COUPLERS, WHICH HAVE EXCELLENT PROPERTIES SUCH AS EXCELLENT WATER RESISTANCE, CHEMICAL RESISTANCE, SOLVENT KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1999-12-21 — — US disclosed
EP-0913430-A1 CONDENSED AZO COMPOUND AND PROCESS FOR PRODUCING THE SAME KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1999-05-06 — — EP disclosed
Send feedback