SCHEMBL8095641

SCHEMBL8095641

Cc1cc(Cc2ccc(CCCCCCCCCCc3ccc(Cc4cc(C)c(N)c(C)c4)cc3)cc2)cc(C)c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.46
HTR2A P28223 1/20 0.41
ESR1 P03372 3/20 0.39
MAOB P27338 2/20 0.39
ESR2 Q92731 1/20 0.39
ALDH1A1 P00352 4/20 0.38
CYP3A4 P08684 3/20 0.38
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
TP53 P04637 2/20 0.38
IGF1R P08069 1/20 0.38
ALOX15 P16050 1/20 0.38
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37

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
SCHEMBL8095659 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8094887 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8096326 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8094859 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8086465 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8100282 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8101489 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8094499 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8099059 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2
SCHEMBL8096041 1.00 SKP2 (0.46) SKP2HTR2AESR1MAOBESR2

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