SCHEMBL8093866

SCHEMBL8093866

CCc1cc(Cc2ccc(CCCCCCCCCCCCCCCCCCc3ccc(Cc4ccc(N)c(CC)c4)cc3)cc2)ccc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.42
HTR2A P28223 1/20 0.42
ALDH1A1 P00352 5/20 0.41
MAPT P10636 3/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 3/20 0.40
POLB P06746 2/20 0.40
CYP3A4 P08684 2/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
CDC25B P30305 1/20 0.40
CASP6 P55212 1/20 0.40
RCE1 Q9Y256 1/20 0.40
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38

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
SCHEMBL8095806 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8100107 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8102159 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8096051 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8085905 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8095809 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8101910 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8093157 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8102269 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E
SCHEMBL8086367 1.00 SKP2 (0.42) SKP2HTR2AALDH1A1MAPTKDM4E

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