SCHEMBL8101931

SCHEMBL8101931

Cc1cc(N)cc(C)c1Cc1ccc(CCCCCCCCCCCCCCCCCCc2ccc(Cc3c(C)cc(N)cc3C)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.42
SKP2 Q13309 1/20 0.41
HTR2A P28223 1/20 0.40
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
IGF1R P08069 1/20 0.37
ALOX15 P16050 1/20 0.37
CYP3A4 P08684 2/20 0.37
GFER P55789 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 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
SCHEMBL8087191 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8102165 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8099413 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8095835 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8093237 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8101186 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8096529 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8093599 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8095877 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E
SCHEMBL8085904 1.00 MAOB (0.42) MAOBSKP2HTR2AALDH1A1KDM4E

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