SCHEMBL774781

SCHEMBL774781

CCCCCCCCCCCCCCCC=Cc1ccco1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
POLB P06746 3/20 0.43
MEN1 O00255 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
BLM P54132 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
FAAH O00519 1/20 0.42
HCAR2 Q8TDS4 1/20 0.40
EPHX2 P34913 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL31233926 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL774378 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL775555 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL19536211 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL774379 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL23870571 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL774780 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL8165550 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL2606180 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1GAAMAPT
SCHEMBL19514134 0.98 FAAH (0.44) ALDH1A1POLBMEN1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120071551-A1 ETHANOLIC EXTRACTS OF HASS AVOCADO SEEDS, Persea americana Mill., AND ITS USE AS MITICIDE FOR Panonychus citri, Oligonychus yothersi, AND Tetranychus cinnabarinus, AND AS AN INSECTICIDE FOR Trialeurodes vaporariorum INSTITUTO DE INVESTIGACIONES AGROPECUARIAS (INIA) (CL) 2012-03-22 US claimed
US-20120071551-A1 ETHANOLIC EXTRACTS OF HASS AVOCADO SEEDS, Persea americana Mill., AND ITS USE AS MITICIDE FOR Panonychus citri, Oligonychus yothersi, AND Tetranychus cinnabarinus, AND AS AN INSECTICIDE FOR Trialeurodes vaporariorum INSTITUTO DE INVESTIGACIONES AGROPECUARIAS (INIA) (CL) 2012-03-22 US disclosed
US-20120071551-A1 ETHANOLIC EXTRACTS OF HASS AVOCADO SEEDS, Persea americana Mill., AND ITS USE AS MITICIDE FOR Panonychus citri, Oligonychus yothersi, AND Tetranychus cinnabarinus, AND AS AN INSECTICIDE FOR Trialeurodes vaporariorum INSTITUTO DE INVESTIGACIONES AGROPECUARIAS (INIA) (CL) 2012-03-22 US disclosed
US-6133313-A SPECIFIED AVOCADOFURANS SUCH AS 2-(TETRADECYL)FURAN, 2-(PENTADECYL)FURAN, 2-(HEXADECYL)FURAN, 2-(HEPTADECYL)FURAN, 2-(OCTADECYL)FURAN, 2-(1E-PENTADECENYL)FURAN, DERIVED FROM IDIOBLAST OIL CELLS OF AVOCADO; CONTROLLING SPODOPTERA EXIGUA THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-10-17 US disclosed