SCHEMBL10033296

SCHEMBL10033296

CCCCCCCC(=O)Nc1ccc(O)c(N)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
LMNA P02545 2/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
EP300 Q09472 1/20 0.56
PSMB11 A5LHX3 1/20 0.56
PSMA7 O14818 1/20 0.56
PSMB1 P20618 1/20 0.56
PSMA1 P25786 1/20 0.56
PSMA2 P25787 1/20 0.56
PSMA3 P25788 1/20 0.56
PSMA4 P25789 1/20 0.56
PSMB8 P28062 1/20 0.56

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
SCHEMBL26417400 0.90 ICMT (0.53) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL15894575 0.87 ALDH1A1 (0.68) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL9165842 0.84 NPC1 (0.59) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL2889506 0.84 NPC1 (0.59) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL8756319 0.84 ALDH1A1 (0.69) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL8390688 0.83 ALDH1A1 (0.59) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL7935161 0.82 L3MBTL1 (0.60) ALDH1A1CA1CA2LMNANPC1
SCHEMBL30020929 0.82 L3MBTL1 (0.60) ALDH1A1CA1CA2LMNANPC1
SCHEMBL11218084 0.82 HDAC3 (0.59) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL11216552 0.82 HDAC3 (0.59) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103154808-B LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-08-19 CN disclosed
CN-103154808-A Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element using same NISSAN CHEMICAL IND LTD 2013-06-12 CN disclosed
WO-2012002501-A1 LIQUID CRYSTAL ALIGNMENT TREATMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT EQUIPPED WITH THE LIQUID CRYSTAL ALIGNMENT FILM 日産化学工業株式会社 (JP) 2012-01-05 WO disclosed