SCHEMBL9488200

SCHEMBL9488200

CCCCCCC(F)COc1ccccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 2/20 0.42
JAK2 O60674 1/20 0.42
HTR1A P08908 1/20 0.39
PPARG P37231 2/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
MEN1 O00255 1/20 0.38
NR1I2 O75469 1/20 0.38
CHRM2 P08172 1/20 0.38
CYP3A4 P08684 1/20 0.38
ADRA2A P08913 1/20 0.38
OPRK1 P41145 1/20 0.38
HTR2B P41595 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CA1 P00915 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
SCHEMBL9437435 0.85 PRSS1 (0.47) LMNAMAPTGAAJAK2HTR1A
SCHEMBL9488066 0.84 PPARG (0.37) LMNAMAPTPPARGPRSS1PRSS2
SCHEMBL18038533 0.84 HTR1A (0.49) LMNAMAPTGAAJAK2HTR1A
SCHEMBL8375387 0.81 KMT2A (0.53) LMNAMAPTPRSS1PRSS2PRSS3
SCHEMBL6346051 0.80 LMNA (0.40) LMNAMAPTGAAJAK2HTR1A
SCHEMBL6441845 0.80 LMNA (0.40) LMNAMAPTGAAJAK2HTR1A
SCHEMBL10583709 0.79 HTR1A (0.41) MAPTHTR1APPARGPRSS1PRSS2
SCHEMBL9148171 0.78 LTA4H (0.49) LMNAHTR1ANR1I2CHRM2CYP3A4
SCHEMBL9145900 0.78 LTA4H (0.49) LMNAHTR1ANR1I2CHRM2CYP3A4
SCHEMBL4859448 0.78 JAK2 (0.38) LMNAMAPTGAAJAK2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0315958-B1 OPTICALLY ACTIVE MESOMORPHIC COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME CANON KABUSHIKI KAISHA (JP) 1993-03-10 EP disclosed
US-4917821-A Optically active mesomorphic compound and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1990-04-17 US disclosed