SCHEMBL7189368

SCHEMBL7189368

COc1ccc(C(=O)N/N=C(\C)c2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.74
MAPT P10636 8/20 0.72
CYP1A2 P05177 2/20 0.72
RAB9A P51151 8/20 0.69
KDM4E B2RXH2 3/20 0.69
NPC1 O15118 7/20 0.68
SMN1; SMN2 Q16637 5/20 0.68
KMT2A Q03164 3/20 0.68
MEN1 O00255 2/20 0.68
CYP3A4 P08684 1/20 0.68
NFKB1 P19838 1/20 0.68
CYP2C19 P33261 1/20 0.68
CASP3 P42574 1/20 0.68
NFKB2 Q00653 1/20 0.68
RELA Q04206 1/20 0.68
SENP7 Q9BQF6 1/20 0.68
SENP6 Q9GZR1 1/20 0.68
ALDH1A1 P00352 4/20 0.64
PSMD14 O00487 1/20 0.64
HPGD P15428 1/20 0.64

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
SCHEMBL5796073 1.00 GAA (0.74) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL7198962 1.00 GAA (0.74) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL5822412 1.00 GAA (0.74) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL1563351 0.87 RAB9A (0.81) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL5732784 0.87 RAB9A (0.81) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL1563352 0.87 RAB9A (0.81) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL12218576 0.87 GAA (0.72) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL27532371 0.85 RAB9A (0.78) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL12443619 0.85 GAA (1.00) GAAMAPTCYP1A2RAB9AKDM4E
SCHEMBL5800077 0.84 MEN1 (0.70) GAAMAPTCYP1A2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6646106-B1 Polymerizing chiral diphosphine having a C2 axis of symmetry, with one or several polymerizable monomers, said chiral diphosphine consisting of a chiral body bearing two identical functional groups RHODIA CHIMIE (FR) 2003-11-11 US disclosed