SCHEMBL21384971

SCHEMBL21384971

NCC(=O)OCc1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PPIB P23284 1/20 0.41
PPIA P62937 1/20 0.41
PPID Q08752 1/20 0.41
PPIG Q13427 1/20 0.41
CYP3A4 P08684 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
MAOA P21397 1/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
GFER P55789 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAOB P27338 2/20 0.39

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
SCHEMBL31171268 0.86 KMT2A (0.57) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL6453211 0.86 ALDH1A1 (0.47) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL18868431 0.84 ALDH1A1 (0.66) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL11736357 0.83 PPIB (0.44) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL10957335 0.82 IDO1 (0.50) ALDH1A1L3MBTL1LOXL2MEN1KMT2A
SCHEMBL10082417 0.82 CYP1A2 (0.47) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL10676527 0.82 AGXT (0.50) ALDH1A1MAPK1MEN1KMT2ALMNA
SCHEMBL42974 0.82 ALDH1A1 (0.68) ALDH1A1MAPK1L3MBTL1KMT2ALMNA
SCHEMBL932927 0.81 KMT2A (0.45) ALDH1A1MAPK1L3MBTL1LOXL2MEN1
SCHEMBL11896843 0.80 CYP1A2 (0.42) ALDH1A1MAPK1L3MBTL1LOXL2MEN1

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
WO-2019182071-A1 LIQUID CRYSTAL ALIGNMENT AGENT, POLYMER FOR OBTAINING SAME, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME 日産化学株式会社 2019-09-26 WO disclosed
WO-2019182072-A1 POLYUREA COPOLYMER, LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME 日産化学株式会社 2019-09-26 WO disclosed
WO-2019182070-A1 LIQUID CRYSTAL ALIGNING AGENT, POLYMER FOR OBTAINING SAME, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME 日産化学株式会社 2019-09-26 WO disclosed