SCHEMBL9320403

SCHEMBL9320403

Nc1ccc(Oc2ccc(NC(=O)c3ccc(C(=O)Nc4ccc(Oc5ccc(N)cc5)cc4)c(O)c3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 5/20 0.59
HDAC1 Q13547 5/20 0.59
HDAC3 O15379 4/20 0.59
HDAC4 P56524 4/20 0.59
HDAC7 Q8WUI4 4/20 0.59
HDAC2 Q92769 4/20 0.59
HDAC10 Q969S8 4/20 0.59
HDAC11 Q96DB2 4/20 0.59
HDAC8 Q9BY41 4/20 0.59
HDAC6 Q9UBN7 4/20 0.59
HDAC9 Q9UKV0 4/20 0.59
HDAC5 Q9UQL6 4/20 0.59
SNCA P37840 1/20 0.58
PNLIP P16233 6/20 0.56
TDP1 Q9NUW8 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.55
PKM P14618 1/20 0.55
APEX1 P27695 1/20 0.55

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
SCHEMBL9323417 0.92 SNCA (0.69) SNCATDP1MEN1LMNAPOLB
SCHEMBL9321111 0.87 SNCA (0.63) SNCATDP1MEN1LMNAPOLB
SCHEMBL9321026 0.87 SNCA (0.63) HDAC1SNCATDP1MEN1LMNA
SCHEMBL22192221 0.84 POLB (0.79) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL22694283 0.84 POLB (0.79) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL22444366 0.84 POLB (0.79) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL8771228 0.84 POLB (0.79) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL9812466 0.84 POLB (0.79) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL9321085 0.84 KLKB1 (0.65) SNCATDP1MEN1LMNAPOLB
SCHEMBL9323451 0.84 SNCA (0.58) SNCATDP1MEN1LMNAPOLB

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-0387106-B1 Novel diamine compounds, production of the same and polyamideimide resins produced therefrom TOMOEGAWA PAPER CO LTD (JP) 1994-02-02 EP disclosed
US-5019642-A Novel diamine compounds, production of the same and polyamideimide resins produced therefrom TOMOEGAWA PAPER CO., LTD. (JP) 1991-05-28 US disclosed
EP-0387106-A1 Novel diamine compounds, production of the same and polyamideimide resins produced therefrom TOMOEGAWA PAPER CO. LTD. (JP) 1990-09-12 EP disclosed