SCHEMBL8452011

SCHEMBL8452011

CCCCCC1CCC(CCC2CCC(c3cc(F)c(CCc4cc(F)c(Cl)c(F)c4)c(F)c3)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 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
SCHEMBL8452009 1.00 SPHK1 (0.32) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8452006 1.00 SPHK1 (0.32) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8447483 0.99 SPHK1 (0.34) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8447479 0.99 SPHK1 (0.34) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8451969 0.99 SPHK1 (0.34) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8451973 0.99 SPHK1 (0.34) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8451976 0.99 SPHK1 (0.34) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8447478 0.99 SPHK1 (0.34) SPHK1MEN1KMT2AGAAMAPT
SCHEMBL8448212 0.96 CYP1A2 (0.30) SPHK1
SCHEMBL8448210 0.96 CYP1A2 (0.30) SPHK1

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