SCHEMBL8094754

SCHEMBL8094754

CCCCc1cc(Cc2ccc(CCCc3ccc(Cc4ccc(N)c(CCCC)c4)cc3)cc2)ccc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.53
CA2 P00918 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTR2A P28223 1/20 0.41
ATP4A P20648 1/20 0.40
ATP4B P51164 1/20 0.40
ALDH1A1 P00352 3/20 0.40
CA1 P00915 1/20 0.40
PLK1 P53350 1/20 0.39
RAB9A P51151 2/20 0.39
CYP3A4 P08684 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR1D P28221 1/20 0.39
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL8096077 0.97 SKP2 (0.53) SKP2CA2SMN1; SMN2HTR2AATP4A
SCHEMBL8093757 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8093713 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8095213 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8099884 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8102308 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8099719 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8096212 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8092708 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1
SCHEMBL8096642 0.95 SKP2 (0.51) SKP2CA2SMN1; SMN2HTR2AALDH1A1

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