SCHEMBL7153196

SCHEMBL7153196

C=CCOC(=O)C(C#N)=Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTP4A3 O75365 2/20 0.63
PTP4A1 Q93096 2/20 0.63
ALDH1A1 P00352 7/20 0.57
MAPT P10636 3/20 0.57
RECQL P46063 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
PTP4A2 Q12974 1/20 0.55
MCL1 Q07820 1/20 0.54
POLB P06746 1/20 0.51
PDCD1 Q15116 1/20 0.50
CD274 Q9NZQ7 1/20 0.50
KDM4E B2RXH2 4/20 0.49
LMNA P02545 2/20 0.49
PLIN1 O60240 1/20 0.49
PLIN5 Q00G26 1/20 0.49
ABHD5 Q8WTS1 1/20 0.49
DNM1 Q05193 2/20 0.48
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL7153194 1.00 PTP4A3 (0.63) PTP4A3PTP4A1ALDH1A1MAPTRECQL
SCHEMBL30289962 0.87 ALDH1A1 (0.59) PTP4A3PTP4A1ALDH1A1MAPTRECQL
SCHEMBL278655 0.82 MAPT (0.71) PTP4A1ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL988236 0.82 MAPT (0.71) PTP4A1ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL988238 0.82 MAPT (0.71) PTP4A1ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL8219793 0.81 MEN1 (0.64) PTP4A3PTP4A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL7105891 0.81 ALDH1A1 (0.59) ALDH1A1MAPTRECQLSMN1; SMN2TDP1
SCHEMBL8665795 0.80 MCL1 (0.58) ALDH1A1MAPTRECQLSMN1; SMN2TDP1
SCHEMBL8105743 0.80 MCL1 (0.58) ALDH1A1MAPTRECQLSMN1; SMN2TDP1
SCHEMBL6288771 0.80 PTP4A3 (0.51) PTP4A3PTP4A1ALDH1A1MAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1185537-B1 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES LORD CORP (US) 2003-10-01 EP claimed
EP-1185537-A1 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES Lord Corporation (US) 2002-03-13 EP claimed
WO-2001018009-A2 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES LORD CORPORATION (US) 2001-03-15 WO claimed
EP-1185537-B1 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES LORD CORP (US) 2003-10-01 EP disclosed
EP-1185537-B1 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES LORD CORP (US) 2003-10-01 EP disclosed
WO-2001018009-A3 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES LORD CORP (US) 2002-05-23 WO disclosed
EP-1185537-A1 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES Lord Corporation (US) 2002-03-13 EP disclosed
EP-1185537-A1 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES Lord Corporation (US) 2002-03-13 EP disclosed
WO-2001018009-A2 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES LORD CORPORATION (US) 2001-03-15 WO disclosed
WO-2001018009-A2 BENZYLIDENECYANOACETATES AND A METHOD FOR MAKING BENZYLIDENECYANOACETATES LORD CORPORATION (US) 2001-03-15 WO disclosed
US-6180813-B1 COMPOUNDS WHICH ARE LIQUID AT ROOM TEMPERATURE, HAVE LOW VOLATILITY AND ARE ODOR FREE; USEFUL IN FORMULATING ADHESIVES AND COATINGS LORD CORPORATION 2001-01-30 US disclosed
US-6180813-B1 COMPOUNDS WHICH ARE LIQUID AT ROOM TEMPERATURE, HAVE LOW VOLATILITY AND ARE ODOR FREE; USEFUL IN FORMULATING ADHESIVES AND COATINGS LORD CORPORATION 2001-01-30 US disclosed