SCHEMBL19901327

SCHEMBL19901327

C=CC(=O)OCCCC(C)CCOc1ccc(C)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
THRB P10828 1/20 0.49
HPGD P15428 3/20 0.45
TSHR P16473 2/20 0.45
HTT P42858 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.40
PPARA Q07869 2/20 0.39
ALOX5 P09917 2/20 0.39
PTGES O14684 1/20 0.39
PPARG P37231 1/20 0.39
NPC1 O15118 1/20 0.38
EPHX2 P34913 1/20 0.38

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
SCHEMBL20354075 0.96 MEN1 (0.49) MEN1KMT2ATHRBHPGDTSHR
SCHEMBL12260077 0.86 THRB (0.59) MEN1KMT2ATHRBHPGDTSHR
SCHEMBL10065788 0.86 THRB (0.59) MEN1KMT2ATHRBHPGDTSHR
SCHEMBL31078048 0.85 THRB (0.45) KMT2ATHRBHPGDTSHRHTT
SCHEMBL18351562 0.85 THRB (0.45) KMT2ATHRBHPGDTSHRHTT
SCHEMBL9906537 0.85 THRB (0.45) KMT2ATHRBHPGDTSHRHTT
SCHEMBL12173361 0.85 TSHR (0.59) MEN1KMT2ATHRBHPGDTSHR
SCHEMBL26126205 0.85 TSHR (0.59) MEN1KMT2ATHRBHPGDTSHR
SCHEMBL13572565 0.85 TSHR (0.59) MEN1KMT2ATHRBHPGDTSHR
SCHEMBL12356583 0.85 TSHR (0.59) MEN1KMT2ATHRBHPGDTSHR

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-9904112-B2 Composition, alignment layer and method for preparing same, liquid crystal alignment unit and liquid crystal display panel BOE TECHNOLOGY GROUP CO., LTD. (CN) 2018-02-27 US disclosed
US-9904112-B2 Composition, alignment layer and method for preparing same, liquid crystal alignment unit and liquid crystal display panel BOE TECHNOLOGY GROUP CO., LTD. (CN) 2018-02-27 US disclosed