SCHEMBL6898908

SCHEMBL6898908

CCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)c(F)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.42
CYP2C9 P11712 1/20 0.40
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
PDE5A O76074 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
PDE4A P27815 2/20 0.33
FPR2 P25090 2/20 0.33
BRD4 O60885 3/20 0.33
HTT P42858 1/20 0.32
FGFR2 P21802 1/20 0.32
DHODH Q02127 1/20 0.32
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 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
SCHEMBL8932591 0.92 KDM1A (0.40) KDM1ACYP2C9ALDH1A1MAPTLMNA
SCHEMBL15381563 0.89 KDM1A (0.43) KDM1APDE5AHDAC1HDAC6PDE4A
SCHEMBL8932686 0.89 KDM1A (0.38) KDM1ACYP2C9ALDH1A1MAPTLMNA
SCHEMBL22277229 0.89 CYP2C9 (0.38) KDM1ACYP2C9ALDH1A1MAPTLMNA
SCHEMBL15381599 0.89 KDM1A (0.39) KDM1ACYP2C9PDE5AHDAC1HDAC6
SCHEMBL11060799 0.87 KDM1A (0.55) KDM1ACYP2C9ALDH1A1MAPTLMNA
SCHEMBL11060802 0.87 KDM1A (0.55) KDM1ACYP2C9ALDH1A1MAPTLMNA
SCHEMBL12032156 0.86 KDM1A (0.42) KDM1ACYP2C9MAPTMEN1MAPK1
SCHEMBL11112346 0.86 CYP2C9 (0.50) KDM1ACYP2C9ALDH1A1MAPTLMNA
SCHEMBL11112304 0.86 CYP2C9 (0.50) KDM1ACYP2C9ALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10519377-B1 Liquid crystal composition of negative monomer containing cyclopentyl cyclohexenyl and liquid crystal display element or liquid crystal display thereof Shijiazhuang Chengzhi Yonghua Display Material Co., Ltd (CN) 2019-12-31 US disclosed
EP-1026143-B1 NOVEL LIQUID-CRYSTAL COMPOUNDS HAVING LARGE NEGATIVE VALUE OF PERMITTIVITY ANISOTROPY, LIQUID-CRYSTAL COMPOSITION, AND LIQUID-CRYSTAL DISPLAY ELEMENT CHISSO CORP (JP) 2004-05-12 EP disclosed
US-20020030179-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS HAVING LARGE NEGATIVE VALUE OF PERMITTIVITY ANISOTROPY, LIQUID-CRYSTAL COMPOSITION, AND LIQUID-CRYSTAL DISPLAY ELEMENT JNC CORPORATION (JP) 2002-03-14 US disclosed
US-6348244-B1 COMPOUNDS HAVING 2,3-DIFLUOROPHENYL MOIETY; IN-PLANE SWITCHING DISPLAY DEVICES; VERTICAL ALIGNMENT CELLS CHISSO CORPORATION (JP) 2002-02-19 US disclosed
EP-1026143-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS HAVING LARGE NEGATIVE VALUE OF PERMITTIVITY ANISOTROPY, LIQUID-CRYSTAL COMPOSITION, AND LIQUID-CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 2000-08-09 EP disclosed