SCHEMBL18906013

SCHEMBL18906013

O=C(Nc1cccc(CO)c1)c1ccoc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 4/20 0.68
KCNK9 Q9NPC2 4/20 0.68
PARP1 P09874 1/20 0.54
RAB9A P51151 2/20 0.52
MAPK14 Q16539 4/20 0.52
LMNA P02545 2/20 0.47
MAPK1 P28482 2/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
ALOX12 P18054 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PPARD Q03181 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
PDK1 Q15118 1/20 0.46
PDK2 Q15119 1/20 0.46

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
SCHEMBL24211485 0.87 KCNK3 (0.66) KCNK3KCNK9PARP1RAB9AMAPK14
SCHEMBL5124799 0.87 KCNK3 (0.66) KCNK3KCNK9PARP1RAB9AMAPK14
SCHEMBL18906011 0.82 KCNK3 (0.54) KCNK3KCNK9PARP1RAB9AMAPK14
SCHEMBL5335860 0.82 KMT2A (0.62) KCNK3KCNK9RAB9ALMNAMAPK1
SCHEMBL20473774 0.80 KCNK3 (0.71) KCNK3KCNK9RAB9ALMNAMAPK1
SCHEMBL14281776 0.79 KCNK3 (0.71) KCNK3KCNK9RAB9ALMNANPC1
SCHEMBL18906023 0.79 KCNK3 (0.81) KCNK3KCNK9RAB9AMAPK14NPC1
SCHEMBL31401957 0.78 KCNK3 (0.83) KCNK3KCNK9RAB9AMAPK14SMN1; SMN2
SCHEMBL6586091 0.78 KCNK3 (0.78) KCNK3KCNK9PARP1RAB9AMAPK14
SCHEMBL10589415 0.78 KCNK3 (0.79) KCNK3KCNK9RAB9AMAPK14NPC1

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-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed