SCHEMBL8087516

SCHEMBL8087516

CCCc1cc(Cc2ccc(CCCc3ccc(Cc4ccc(N)c(CCC)c4)cc3)cc2)ccc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.46
ALDH1A1 P00352 5/20 0.41
GAA P10253 3/20 0.40
KDM4E B2RXH2 3/20 0.40
CYP3A4 P08684 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR2A P28223 1/20 0.38
CDC25B P30305 1/20 0.36
CASP6 P55212 1/20 0.36
RCE1 Q9Y256 1/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ATP4A P20648 1/20 0.36
ATP4B P51164 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL8092006 0.97 SKP2 (0.46) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8101687 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8086385 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8087706 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8087583 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8087369 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8101318 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8086527 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8094063 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4
SCHEMBL8099765 0.95 SKP2 (0.45) SKP2ALDH1A1GAAKDM4ECYP3A4

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