SCHEMBL6662839

SCHEMBL6662839

CCCCCC1CCC(c2ccc(C(F)(F)OC(C)c3ccc(C4CCC(C)CC4)cc3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.34
ESR2 Q92731 2/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
SPHK1 Q9NYA1 3/20 0.33
GAA P10253 1/20 0.31
CNR2 P34972 7/20 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
SCHEMBL6664252 1.00 MAPT (0.36) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6666560 0.99 MAPT (0.35) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6660738 0.96 MAPT (0.38) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6667373 0.93 MAPT (0.42) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6661882 0.93 MAPT (0.42) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6660745 0.92 MAPT (0.36) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6667714 0.92 MAPT (0.36) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6664008 0.92 ALDH1A1 (0.43) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6665226 0.92 ALDH1A1 (0.43) MAPTALDH1A1LMNACYP2C9ESR2
SCHEMBL6665739 0.89 SPHK1 (0.46) MAPTALDH1A1LMNASPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed