SCHEMBL7936971

SCHEMBL7936971

C/C=C/COCCCCC

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
LSS P48449 1/20 0.39
CES2 O00748 2/20 0.39
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 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
SCHEMBL135519 1.00 HTT (0.41) HTTMEN1THRBKMT2AMAPT
SCHEMBL11121632 0.98 HTT (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL14938976 0.98 HTT (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL9146283 0.98 HTT (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL9148832 0.98 HTT (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL14939101 0.98 HTT (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL14939100 0.98 HTT (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL9050529 0.98 HTT (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL13239726 0.94 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL4293263 0.93

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6175036-B1 CATALYZING THE CARBOXYLATION OF AN ALKOXY-BUTENE WITH CARBON MONOXIDE IN THE PRESENCE OF A CATALYST SYSTEM COMPRISING PALLADIUM, A PHOSPHORUS LIGAND AND AN ACID PROMOTOR DSM N.V. (NL) 2001-01-16 US claimed
EP-0975574-A1 PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE DSM N.V. (NL) 2000-02-02 EP claimed
WO-1998038151-A1 PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE DSM N.V. (NL) 1998-09-03 WO claimed
EP-0005452-B1 ACYLOXY-2-BUTENES, THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF 4-ACETOXYTIGLINALDEHYDE BASF Aktiengesellschaft (DE) 1980-10-01 EP claimed
EP-0005452-A1 Acyloxy-2-butenes, their preparation and their use for the preparation of 4-acetoxytiglinaldehyde BASF Aktiengesellschaft (DE) 1979-11-28 EP claimed
EP-0004622-A1 Process for preparing crotonaldehyde and crotonaldehyde derivatives BASF Aktiengesellschaft (DE) 1979-10-17 EP claimed
US-6175036-B1 CATALYZING THE CARBOXYLATION OF AN ALKOXY-BUTENE WITH CARBON MONOXIDE IN THE PRESENCE OF A CATALYST SYSTEM COMPRISING PALLADIUM, A PHOSPHORUS LIGAND AND AN ACID PROMOTOR DSM N.V. (NL) 2001-01-16 US disclosed
US-6175036-B1 CATALYZING THE CARBOXYLATION OF AN ALKOXY-BUTENE WITH CARBON MONOXIDE IN THE PRESENCE OF A CATALYST SYSTEM COMPRISING PALLADIUM, A PHOSPHORUS LIGAND AND AN ACID PROMOTOR DSM N.V. (NL) 2001-01-16 US disclosed
CN-1252786-A Process to prepare a pentenoic acid derivative DSM NV (NL) 2000-05-10 CN disclosed
EP-0975574-A1 PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE DSM N.V. (NL) 2000-02-02 EP disclosed
EP-0975574-A1 PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE DSM N.V. (NL) 2000-02-02 EP disclosed
WO-1998038151-A1 PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE DSM N.V. (NL) 1998-09-03 WO disclosed
WO-1998038151-A1 PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE DSM N.V. (NL) 1998-09-03 WO disclosed
US-4618704-A Acyloxy-2-butenes and their preparation BASF AKTIENGESELLSCHAFT (DE) 1986-10-21 US disclosed
EP-0033589-A1 Method of preparing a catalyst for synthesizing unsaturated esters TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1981-08-12 EP disclosed
EP-0005452-B1 ACYLOXY-2-BUTENES, THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF 4-ACETOXYTIGLINALDEHYDE BASF Aktiengesellschaft (DE) 1980-10-01 EP disclosed
EP-0005452-B1 ACYLOXY-2-BUTENES, THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF 4-ACETOXYTIGLINALDEHYDE BASF Aktiengesellschaft (DE) 1980-10-01 EP disclosed
EP-0005452-A1 Acyloxy-2-butenes, their preparation and their use for the preparation of 4-acetoxytiglinaldehyde BASF Aktiengesellschaft (DE) 1979-11-28 EP disclosed
EP-0005452-A1 Acyloxy-2-butenes, their preparation and their use for the preparation of 4-acetoxytiglinaldehyde BASF Aktiengesellschaft (DE) 1979-11-28 EP disclosed
EP-0005452-A1 Acyloxy-2-butenes, their preparation and their use for the preparation of 4-acetoxytiglinaldehyde BASF Aktiengesellschaft (DE) 1979-11-28 EP disclosed