SCHEMBL9344705

SCHEMBL9344705

CCCC1CCC(CCCOc2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.53
KCNA3 P22001 1/20 0.50
HRH3 Q9Y5N1 3/20 0.46
HTR1B P28222 1/20 0.44
MLNR O43193 1/20 0.44
NR1I2 O75469 1/20 0.44
ESR1 P03372 1/20 0.44
NR3C1 P04150 1/20 0.44
PGR P06401 1/20 0.44
ADRB2 P07550 1/20 0.44
CHRM2 P08172 1/20 0.44
ADRB1 P08588 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD2 P14416 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
CHRM3 P20309 1/20 0.44

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
SCHEMBL9344709 1.00 LTA4H (0.53) LTA4HKCNA3HRH3HTR1BMLNR
SCHEMBL9345495 0.95 LTA4H (0.49) LTA4HKCNA3HRH3HTR1BMLNR
SCHEMBL9345497 0.95 LTA4H (0.49) LTA4HKCNA3HRH3HTR1BMLNR
SCHEMBL8078945 0.95 KCNA3 (0.53) LTA4HKCNA3HRH3HTR1BMLNR
SCHEMBL8753521 0.95 KCNA3 (0.53) LTA4HKCNA3HRH3HTR1BMLNR
SCHEMBL8529857 0.91 LTA4H (0.50) LTA4HKCNA3HRH3CHRNB2CHRNB4
SCHEMBL8081852 0.91 LTA4H (0.50) LTA4HKCNA3HRH3CHRNB2CHRNB4
SCHEMBL9344601 0.91 HRH3 (0.49) LTA4HHRH3ALDH1A1CYP3A4
SCHEMBL9344596 0.91 HRH3 (0.49) LTA4HHRH3ALDH1A1CYP3A4
SCHEMBL9344251 0.89 HRH3 (0.48) LTA4HHRH3ALDH1A1CYP3A4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0393636-B1 Liquid crystal composition and liquid crystal display using said composition CHISSO CORP (JP) 1994-07-20 EP disclosed
US-5258135-A Multiplexed displays, supertwisted birefringence effect CHISSO CORPORATION (JP) 1993-11-02 US disclosed
EP-0432780-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY USING SAID COMPOSITION CHISSO CORPORATION (JP) 1993-07-21 EP disclosed
US-5102577-A Supertwisted birefringence system CHISSO CORPORATION (JP) 1992-04-07 US disclosed
EP-0432780-A1 Liquid crystal composition and liquid crystal display using said composition CHISSO CORPORATION (JP) 1991-06-19 EP disclosed
EP-0393636-A2 Liquid crystal composition and liquid crystal display using said composition CHISSO CORPORATION (JP) 1990-10-24 EP disclosed