SCHEMBL2133100

SCHEMBL2133100

CCCOC(=O)Cc1cc(N)cc(N)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
HSP90AB1 P08238 1/20 0.42
ALOX5 P09917 1/20 0.39
YWHAG P61981 1/20 0.39
CYP19A1 P11511 1/20 0.37
LMNA P02545 2/20 0.37
PAM P19021 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
PDE4D Q08499 1/20 0.37
MAOB P27338 1/20 0.36

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
SCHEMBL2132737 0.90 TSHR (0.49) ALDH1A1LMNAHSD17B10CYP1A2CYP3A4
SCHEMBL2131830 0.85 SMN1; SMN2 (0.46) ALDH1A1HSP90AB1LMNAHPGDCYP1A2
SCHEMBL11038201 0.82 CYP1A2 (0.47) ALDH1A1YWHAGCYP19A1LMNAKDM4E
SCHEMBL5627469 0.81 SMN1; SMN2 (0.46) ALDH1A1HSP90AB1LMNAHPGDCYP1A2
SCHEMBL2133003 0.77 HSP90AB1 (0.62) ALDH1A1HSP90AB1LMNAHPGDHSD17B10
SCHEMBL16389938 0.76 APP (0.44) ALDH1A1ALOX5YWHAGLMNACYP1A2
SCHEMBL27500595 0.75 ALDH1A1 (0.59) ALDH1A1ALOX5LMNAPAMKDM4E
SCHEMBL16389939 0.75 GAA (0.42) ALDH1A1ALOX5YWHAGLMNAKDM4E
SCHEMBL17161212 0.75 SMN1; SMN2 (0.41) ALDH1A1LMNAHPGDCYP1A2CYP3A4
SCHEMBL8852497 0.74 TSHR (0.48) ALDH1A1LMNAKDM4EHSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104178181-B Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2017-04-12 CN disclosed
CN-104178181-A LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORP 2014-12-03 CN disclosed
US-20140350179-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING THEREOF CHI MEI CORPORATION (TW) 2014-11-27 US disclosed
US-8673177-B2 Liquid crystal alignment agent, and liquid crystal alignment film and liquid crystal display element formed from the liquid crystal alignment agent CHI MEI CORPORATION (TW) 2014-03-18 US disclosed
CN-102453486-A Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element CHI MEI CORP 2012-05-16 CN disclosed
US-20120101224-A1 LIQUID CRYSTAL ALIGNMENT AGENT, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT FORMED FROM THE LIQUID CRYSTAL ALIGNMENT AGENT CHI MEI CORPORATION (TW) 2012-04-26 US disclosed