SCHEMBL7765677

SCHEMBL7765677

CCCCCCOc1cc(C#N)c(O)cc1C#N

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
HPGD P15428 1/20 0.58
SMPD1 P17405 1/20 0.42

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
SCHEMBL28425205 0.90 ALDH1A1 (0.63) ALDH1A1HPGD
SCHEMBL3715087 0.83 ALDH1A1 (0.63) ALDH1A1HPGD
SCHEMBL28035088 0.83 ALDH1A1 (0.63) ALDH1A1HPGD
SCHEMBL8448469 0.83 ALDH1A1 (0.63) ALDH1A1HPGD
SCHEMBL7608578 0.83 ALDH1A1 (0.63) ALDH1A1HPGD
SCHEMBL28419965 0.83 ALDH1A1 (0.54) ALDH1A1HPGD
SCHEMBL3297253 0.80 NR5A1 (0.58) ALDH1A1HPGDSMPD1
SCHEMBL9011569 0.79 ALDH1A1 (0.55) ALDH1A1HPGD
SCHEMBL28328487 0.78 ALDH1A1 (0.58) ALDH1A1HPGD
SCHEMBL27434524 0.78 ALDH1A1 (0.66) ALDH1A1HPGD

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
EP-0764713-B1 Liquid crystal device and liquid crystal apparatus CANON KK (JP) 2001-07-18 EP disclosed
US-5858269-A COMPRISING A PAIR OF TRANSPARENT SUBSTRATES; TRANSPARENT ELECTRODES WITH A CHIRAL SMECTIC LIQUID CRYSTAL COMPOSITION DISPOSED BETWEEN SO AS TO ASSUME AT LEAST TWO OPTICALLY STABLE STATES; A POLYIMIDE AND MESOMORPHIC COMPOUND CANON KABUSHIKI KAISHA (JP) 1999-01-12 US disclosed
EP-0764713-A1 Liquid crystal device and liquid crystal apparatus CANON KABUSHIKI KAISHA (JP) 1997-03-26 EP disclosed
EP-0442499-B1 Liquid crystal composition, liquid crystal device, display apparatus and display method using same CANON KK (JP) 1995-09-20 EP disclosed
US-5217643-A Liquid crystal composition, liquid crystal device, display apparatus and display method using same CANON KABUSHIKI KAISHA (JP) 1993-06-08 US disclosed
EP-0442499-A2 Liquid crystal composition, liquid crystal device, display apparatus and display method using same CANON KABUSHIKI KAISHA (JP) 1991-08-21 EP disclosed