SCHEMBL7129914

SCHEMBL7129914

CCCCCC[C@H](C)OC(=O)c1ccc(-c2ccc(-c3ccc(C(=O)O[C@@H](C)CCCCCC)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
TSHR P16473 1/20 0.50
PDCD1 Q15116 1/20 0.49
CD274 Q9NZQ7 1/20 0.49
FAAH O00519 5/20 0.48
RARB P10826 7/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 3/20 0.45
MEN1 O00255 1/20 0.45
RARA P10276 1/20 0.45
MTOR P42345 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL9297228 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL7129328 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL7131132 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL7127663 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL17897419 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL14273580 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL7131644 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL7121088 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL9493320 1.00 ALDH1A1 (0.59) ALDH1A1TSHRPDCD1CD274FAAH
SCHEMBL7171711 0.98 ALDH1A1 (0.57) ALDH1A1TSHRPDCD1CD274FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250338-A1 COMPOUND AND LIQUID CRYSTAL COMPOSITION THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2023-08-10 US disclosed
WO-2017034023-A1 COMPLEX AND OPTICAL ELEMENT 国立大学法人京都大学 2017-03-02 WO disclosed
US-6671028-B1 Distorted helix ferroelectric liquid crystal cell ROLIC AG (CH) 2003-12-30 US disclosed
EP-0407830-B1 Polarizer HOFFMANN LA ROCHE (CH) 1996-09-25 EP disclosed
EP-0405346-B1 Bistable ferroelectric liquid cristal display HOFFMANN LA ROCHE (CH) 1995-09-20 EP disclosed