SCHEMBL7219378

SCHEMBL7219378

C=C(C)C(=O)Oc1ccc(Cc2ccc(CCC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.58
ELANE P08246 2/20 0.49
KMT2A Q03164 3/20 0.47
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
ALDH1A1 P00352 1/20 0.46
ATM Q13315 1/20 0.46
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
PLK1 P53350 1/20 0.42
THRA P10827 2/20 0.41
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40
PPARG P37231 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
SCHEMBL1516212 0.95 THRB (0.63) THRBELANEKMT2APLA2G1BATG4B
SCHEMBL20827825 0.91 THRB (0.58) THRBELANEKMT2APLA2G1BATG4B
SCHEMBL883697 0.91 THRB (0.58) THRBELANEKMT2APLA2G1BATG4B
SCHEMBL2703931 0.90 ELANE (0.57) THRBELANEKMT2AATMMAPT
SCHEMBL7219385 0.88 ELANE (0.66) THRBELANEKMT2APLA2G1BATG4B
SCHEMBL17791332 0.87 ELANE (0.57) THRBELANEKMT2APLA2G1BATG4B
SCHEMBL1401891 0.86 THRB (0.59) THRBELANEKMT2AALDH1A1ATM
SCHEMBL7219064 0.85 THRB (0.52) THRBELANEKMT2APLA2G1BATG4B
SCHEMBL7219060 0.85 THRB (0.52) THRBELANEKMT2APLA2G1BATG4B
SCHEMBL7219077 0.85 THRB (0.52) THRBELANEKMT2APLA2G1BATG4B

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-6624236-B1 Sol-gel-condensable cyclosiloxane(meth) acrylates; dentistry 3M ESPE AG (DE) 2003-09-23 US disclosed
EP-1141094-B1 CYCLOSILOXANE-BASED CROSS-LINKABLE MONOMERS, PRODUCTION THEREOF AND USE THEREOF IN POLYMERISABLE MATERIALS 3M ESPE AG (DE) 2002-07-24 EP disclosed
EP-1141094-A1 CYCLOSILOXANE-BASED CROSS-LINKABLE MONOMERS, PRODUCTION THEREOF AND USE THEREOF IN POLYMERISABLE MATERIALS 3M Espe AG (DE) 2001-10-10 EP disclosed
WO-2000042092-A1 CYCLOSILOXANE-BASED CROSS-LINKABLE MONOMERS, PRODUCTION THEREOF AND USE THEREOF IN POLYMERISABLE MATERIALS 3M ESPE AG (DE) 2000-07-20 WO disclosed