SCHEMBL8834960

SCHEMBL8834960

C=CCCCCCCCS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.65
CYP2C19 P33261 2/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2C9 P11712 1/20 0.65
MCHR1 Q99705 1/20 0.45
KMT2A Q03164 6/20 0.44
NPC1 O15118 1/20 0.44
CTSK P43235 1/20 0.42
MEN1 O00255 1/20 0.41
C5AR1 P21730 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
CA2 P00918 1/20 0.40
PAX8 Q06710 1/20 0.40
TLR9 Q9NR96 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL9300459 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL8834639 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL8834822 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL8835388 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL9299607 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL8834888 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL9299392 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL8834905 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL8834611 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1
SCHEMBL8834920 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19CYP3A4CYP2C9MCHR1

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
US-5686021-A Liquid crystal display device, methods of producing and driving the liquid crystal display device, and liquid crystal composition IDEMITSU KOSAN CO., LTD. (JP) 1997-11-11 US disclosed
US-5350538-A High polymer, ferroelectric liquid-crystalline composition containing the high polymer and raw material of the high polymer IDEMITSU KOSAN CO., LTD. (JP) 1994-09-27 US disclosed
EP-0578135-A2 High polymer, ferro-electric liquid-crystalline composition containing the high polymer and raw material of the high polymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1994-01-12 EP disclosed