SCHEMBL8098723

SCHEMBL8098723

CCC(c1ccc(N)cc1)c1ccc(CCCCCCCCCCCCCCc2ccc(C(CC)c3ccc(N)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.57
HTR2A P28223 2/20 0.54
GFER P55789 1/20 0.46
MAOA P21397 2/20 0.45
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A2 P23975 2/20 0.40

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
SCHEMBL8086652 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8098365 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8094285 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8093832 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8100397 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8094694 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8093984 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8095768 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8087537 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E
SCHEMBL8087135 1.00 MAOB (0.57) MAOBHTR2AGFERMAOAKDM4E

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-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed