SCHEMBL676652

SCHEMBL676652

CNc1ccc(O)c(NC(=O)c2ccc(C(c3ccc(C(C)=O)cc3)(C(F)(F)F)C(F)(F)F)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.46
KCNMA1 Q12791 4/20 0.45
RXFP1 Q9HBX9 1/20 0.44
HPSE Q9Y251 1/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 1/20 0.40
TRPV1 Q8NER1 2/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
RORC P51449 1/20 0.39
HDAC2 Q92769 1/20 0.39
AKT1 P31749 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL677917 0.89 KCNMA1 (0.46) HDAC1KCNMA1RXFP1HPSEKMT2A
SCHEMBL677398 0.87 KMT2A (0.48) HDAC1KCNMA1RXFP1KMT2AMEN1
SCHEMBL1108320 0.86 HDAC1 (0.48) HDAC1KCNMA1RXFP1HPSEKMT2A
SCHEMBL676664 0.85 HDAC1 (0.47) HDAC1KCNMA1RXFP1KMT2AMEN1
SCHEMBL12724481 0.83 KMT2A (0.46) HDAC1RXFP1KMT2AMEN1POLB
SCHEMBL12417166 0.82 ESRRA (0.47) HDAC1KCNMA1RXFP1KMT2AMEN1
SCHEMBL677399 0.82 KDR (0.44) HDAC1RXFP1KMT2AMEN1POLB
SCHEMBL1108313 0.81 HPGD (0.49) HDAC1KCNMA1HPSEKMT2APOLB
SCHEMBL13955812 0.81 HDAC1 (0.47) HDAC1KCNMA1KMT2AMEN1POLB
SCHEMBL677384 0.80 MAPT (0.46) HDAC1RXFP1POLBHDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7906213-B2 Epoxy resin curable composition for prepreg ADEKA CORPORATION (JP) 2011-03-15 US disclosed
US-20090030147-A1 Epoxy Resin Curable Composition For Prepreg ADEKA CORPORATION (JP) 2009-01-29 US disclosed