SCHEMBL8060417

SCHEMBL8060417

CC(C)(C)c1ccc(N)c(C2(c3ccccc3N)CCCCC2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM1A O60341 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.32
NPC1 O15118 1/20 0.32
PLA2G1B P04054 1/20 0.32
NFKB1 P19838 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
ATG4B Q9Y4P1 1/20 0.32

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
SCHEMBL8019109 0.80 ALDH1A1 (0.45) ALDH1A1L3MBTL1
SCHEMBL8058021 0.80 TP53 (0.38) ALDH1A1KDM1AL3MBTL1
SCHEMBL8042422 0.77 PDK2 (0.38) ALDH1A1MAPTKDM1AL3MBTL1NPC1
SCHEMBL8055201 0.71 SKP2 (0.42)
SCHEMBL4059983 0.70 KDM1A (0.41) KDM1A
SCHEMBL28400015 0.69 OPRM1 (0.54) ALDH1A1L3MBTL1HSD11B1HSD11B2
SCHEMBL4929120 0.68 ALDH1A1 (0.43) ALDH1A1MEN1MAPTKMT2AKDM1A
SCHEMBL8785507 0.68 KDM1A (0.42) KDM1A
SCHEMBL22051891 0.67 ALDH1A1 (0.41) ALDH1A1MEN1GAAMAPTPKM
SCHEMBL9481839 0.67 ALDH1A1 (0.50) ALDH1A1MEN1GAAMAPTPKM

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-6031067-A Soluble polyimide resin and process of preparation of the same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2000-02-29 US disclosed