SCHEMBL8024694

SCHEMBL8024694

CCCCCCCc1cnc(-c2ccc(OC[C@@H](F)CCCCCC)c(F)c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.46
RAB9A P51151 4/20 0.43
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RARA P10276 1/20 0.37
RARG P13631 1/20 0.37
NPC1 O15118 2/20 0.36
STAT3 P40763 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36

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
SCHEMBL9139470 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9140422 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9140994 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9139918 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9138184 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9137585 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9142554 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9139526 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9141684 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9144712 0.90 RARB (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6146547-A USEFUL AS COMPONENT OF FERROELECTRIC LIQUID CRYSTAL FORMULATIONS CHISSO CORPORATION (JP) 2000-11-14 US disclosed
EP-0278665-B1 2-Substituted-alkyl ether and liquid crystal composition CHISSO CORP (JP) 1994-09-21 EP disclosed
US-5120468-A Optical active mixture exhibiting ferroelectricity CHISSO CORPORATION (JP) 1992-06-09 US disclosed
EP-0278665-A2 2-Substituted-alkyl ether and liquid crystal composition Chisso Corporation (JP) 1988-08-17 EP disclosed