SCHEMBL8448232

SCHEMBL8448232

CCCCCC[C@H]1CC[C@H](CCC2CCC(c3ccc(-c4ccc(Cl)c(F)c4)c(F)c3)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
CYP11B1 P15538 4/20 0.35
CYP11B2 P19099 4/20 0.35
CYP2C9 P11712 3/20 0.34
CYP3A4 P08684 3/20 0.34
FASN P49327 1/20 0.33
RARB P10826 1/20 0.33
SPHK1 Q9NYA1 3/20 0.33
CYP2C8 P10632 1/20 0.32
S1PR3 Q99500 1/20 0.32
APP P05067 2/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
NR1H4 Q96RI1 1/20 0.31

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
SCHEMBL8448424 1.00 MAPT (0.35) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8448422 1.00 MAPT (0.35) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8448230 1.00 MAPT (0.35) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8448420 1.00 MAPT (0.35) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8448234 1.00 MAPT (0.35) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8447516 0.99 CYP11B1 (0.36) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8447520 0.99 CYP11B1 (0.36) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8447517 0.99 CYP11B1 (0.36) MAPTGAACYP11B1CYP11B2CYP2C9
SCHEMBL8452645 0.96 CYP11B1 (0.36) MAPTCYP11B1CYP11B2CYP2C9CYP3A4
SCHEMBL8452638 0.96 CYP11B1 (0.36) MAPTCYP11B1CYP11B2CYP2C9CYP3A4

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