SCHEMBL11269063

SCHEMBL11269063

CCCCc1c(CCCC)c(CCCC)c2ccccc2c1C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 4/20 0.44
HSD17B10 Q99714 3/20 0.44
RAB9A P51151 1/20 0.43
TLR8 Q9NR97 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 2/20 0.39
CYP2D6 P10635 1/20 0.39
SLC2A1 P11166 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NCEH1 Q6PIU2 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
SCHEMBL11763792 0.94 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL29207956 0.92 TLR8 (0.49) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL11577551 0.89 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL28275474 0.89 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL30254408 0.88 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL5713368 0.86 TLR8 (0.51) KDM4EALDH1A1HPGDHSD17B10TLR8
SCHEMBL4887109 0.86 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL29611102 0.86 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL11148331 0.84 TLR8 (0.53) KDM4EALDH1A1HPGDHSD17B10TLR8
SCHEMBL14888795 0.84 TLR8 (0.53) KDM4EALDH1A1HPGDHSD17B10TLR8

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
US-4346015-A Method of improving antiwear properties of high temperature hydrocarbon compositions UNION CARBIDE CORPORATION (US) 1982-08-24 US disclosed
US-4097393-A ENDCAPPED POLYDIMETHYLSILOXANE, BRAKE FLUIDS UNION CARBIDE CORPORATION (US) 1978-06-27 US disclosed