SCHEMBL7109914

SCHEMBL7109914

CCCCC(CC)COC(=O)/C(C#N)=C/c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.64
LMNA P02545 3/20 0.64
MAPK1 P28482 1/20 0.64
CA2 P00918 1/20 0.53
CYP3A4 P08684 1/20 0.53
POLB P06746 2/20 0.48
PRSS1 P07477 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
MAPT P10636 5/20 0.47
PDCD1 Q15116 1/20 0.47
CD274 Q9NZQ7 1/20 0.47
KDM4E B2RXH2 3/20 0.46
TDP1 Q9NUW8 2/20 0.45
KMT2A Q03164 3/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 2/20 0.44
HPGD P15428 2/20 0.44
MCL1 Q07820 1/20 0.44
RECQL P46063 1/20 0.43

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
SCHEMBL7109919 1.00 ALDH1A1 (0.64) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL10644154 0.94 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL2585864 0.93 ALDH1A1 (0.59) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL2585860 0.93 ALDH1A1 (0.59) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL15393023 0.91 ALDH1A1 (0.56) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL22466779 0.91 ALDH1A1 (0.56) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL5047159 0.90 ALDH1A1 (0.57) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL5047156 0.90 ALDH1A1 (0.57) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL4139254 0.89 ALDH1A1 (0.53) ALDH1A1LMNAMAPK1CA2CYP3A4
SCHEMBL4139257 0.89 ALDH1A1 (0.53) ALDH1A1LMNAMAPK1CA2CYP3A4

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 8 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 disclosed
US-6562181-B2 Bonding together two substrates by applying to a first substrate formulation of mixture of trifunctional olefinic monomer, olefinic second monomer that is copolymerizable and free radical initiator; contacting second substrate LORD CORPORATION 2003-05-13 US disclosed
US-20020129896-A1 REACTIVE ADHESIVES AND COATINGS WITH TRIFUNCTIONAL OLEFINIC MONOMERS LORD CORPORATION 2002-09-19 US disclosed
EP-1190007-A2 REACTIVE ADHESIVES AND COATINGS WITH TRIFUNCTIONAL OLEFINIC MONOMERS Lord Corporation (US) 2002-03-27 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
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
WO-2000077079-A2 REACTIVE ADHESIVES AND COATINGS WITH TRIFUNCTIONAL OLEFINIC MONOMERS LORD CORPORATION (US) 2000-12-21 WO disclosed