SCHEMBL8096077

SCHEMBL8096077

CCCCc1cc(Cc2ccc(CCCCc3ccc(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
HTR2A P28223 1/20 0.44
CA2 P00918 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP3A4 P08684 2/20 0.41
LMNA P02545 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 0.41
HSPD1 P10809 1/20 0.41
ADRB3 P13945 1/20 0.41
HTR2C P28335 1/20 0.41

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
SCHEMBL8095213 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8093713 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8093757 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8102308 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8096212 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8096642 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8092708 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8099719 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8099884 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1
SCHEMBL8094311 0.98 SKP2 (0.51) SKP2HTR2ACA2SMN1; SMN2ESR1

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