SCHEMBL9707129

SCHEMBL9707129

CCCCCCCCCCCCc1ccc2c(c1)[nH]c1cc(CCCCCCCCCCCC)ccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.51
HTR1A P08908 1/20 0.50
HTR1D P28221 1/20 0.50
HTR1B P28222 1/20 0.50
ESR1 P03372 2/20 0.48
ADRA2A P08913 2/20 0.48
ADORA3 P0DMS8 2/20 0.48
TACR2 P21452 2/20 0.48
SLC6A2 P23975 2/20 0.48
SLC6A4 P31645 2/20 0.48
SLC6A3 Q01959 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
SHBG P04278 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
HSPD1 P10809 1/20 0.48
ADRB3 P13945 1/20 0.48
HTR2C P28335 1/20 0.48

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
SCHEMBL28298246 1.00 KIF11 (0.51) KIF11HTR1AHTR1DHTR1BESR1
SCHEMBL9707151 1.00 KIF11 (0.51) KIF11HTR1AHTR1DHTR1BESR1
SCHEMBL9707132 1.00 KIF11 (0.51) KIF11HTR1AHTR1DHTR1BESR1
SCHEMBL9707156 1.00 KIF11 (0.51) KIF11HTR1AHTR1DHTR1BESR1
SCHEMBL18611883 0.92 KIF11 (0.55) KIF11HTR1AHTR1DHTR1BLMNA
SCHEMBL23837219 0.92 KIF11 (0.66) KIF11KDM4EALDH1A1HSD17B10PTGES
SCHEMBL9707166 0.92 KIF11 (0.66) KIF11KDM4EALDH1A1HSD17B10PTGES
SCHEMBL9707191 0.92 KIF11 (0.49) KIF11HTR1AHTR1DHTR1BESR1
SCHEMBL9707140 0.92 KIF11 (0.49) KIF11HTR1AHTR1DHTR1BESR1
SCHEMBL9707173 0.92 KIF11 (0.66) KIF11KDM4EALDH1A1HSD17B10PTGES

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-0218422-B1 SEMICONDUCTOR LIGHT-EMITTING ELEMENT KABUSHIKI KAISHA TOSHIBA (JP) 1992-09-16 EP disclosed
US-4819057-A METAL-ORGANIC FILMS-SEMICONDUCTOR JUNCTION KABUSHIKI KAISHA TOSHIBA (JP) 1989-04-04 US disclosed
EP-0218422-A2 Semiconductor light-emitting element KABUSHIKI KAISHA TOSHIBA (JP) 1987-04-15 EP disclosed