SCHEMBL8448366

SCHEMBL8448366

CCCC1CCC(CCC2CC=C(c3ccccc3)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.43
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
DRD2 P14416 2/20 0.35
DRD3 P35462 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DRD4 P21917 1/20 0.33
NPC1 O15118 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
NLRP3 Q96P20 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL8448364 1.00 ESR2 (0.43) ESR2GAAMAPTMAPK1SMN1; SMN2
SCHEMBL10932075 0.95 ESR2 (0.46) ESR2GAAMAPTMAPK1SMN1; SMN2
SCHEMBL8737394 0.94 ESR2 (0.41) ESR2GAAMAPTMAPK1SMN1; SMN2
SCHEMBL8737396 0.94 ESR2 (0.41) ESR2GAAMAPTMAPK1SMN1; SMN2
SCHEMBL10931056 0.92 ESR2 (0.47) ESR2GAAMAPTMAPK1SMN1; SMN2
SCHEMBL20744656 0.92 ESR2 (0.47) ESR2GAAMAPTMAPK1SMN1; SMN2
SCHEMBL11190434 0.87 ESR2 (0.54) ESR2GAAMAPTMAPK1SMN1; SMN2
SCHEMBL28008442 0.86 ESR2 (0.45) ESR2MAPTMAPK1RAB9ANPC1
SCHEMBL10931202 0.86 ESR2 (0.44) ESR2GAAMAPK1DRD2DRD3
SCHEMBL11195824 0.85 ESR2 (0.53) ESR2RAB9ANPC1CASP3SENP8

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-5858275-A Chlorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1999-01-12 US disclosed
EP-0785179-A1 CHLOROBENZENE DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORPORATION (JP) 1997-07-23 EP disclosed