SCHEMBL18906009

SCHEMBL18906009

NCc1cccc(NC(=O)c2ccco2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.67
MAPK1 P28482 2/20 0.65
KCNK3 O14649 2/20 0.65
KCNK9 Q9NPC2 2/20 0.65
LMNA P02545 1/20 0.65
RAB9A P51151 5/20 0.64
MAPT P10636 2/20 0.63
SMN1; SMN2 Q16637 4/20 0.62
KMT2A Q03164 4/20 0.62
NPC1 O15118 3/20 0.62
MEN1 O00255 2/20 0.62
POLB P06746 1/20 0.62
RECQL P46063 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
USP2 O75604 1/20 0.62
TSHR P16473 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62

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
SCHEMBL18906008 0.88 PTPN2 (0.71) ALDH1A1LMNARAB9AMAPTSMN1; SMN2
SCHEMBL23011774 0.87 ALDH1A1 (0.84) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL18906010 0.86 ALDH1A1 (0.68) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL3647264 0.83 ALDH1A1 (0.68) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL4706492 0.81 ALDH1A1 (0.58) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL5243911 0.81 ALDH1A1 (0.58) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL3647261 0.81 MAPK1 (0.76) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL29106508 0.80 MEN1 (0.76) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL30701883 0.80 MEN1 (0.76) ALDH1A1MAPK1KCNK3KCNK9LMNA
SCHEMBL259427 0.80 KCNK3 (0.82) ALDH1A1MAPK1KCNK3KCNK9LMNA

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