SCHEMBL4011687

SCHEMBL4011687

CCN(CC)CCCOc1ccc(NC(=O)COc2c(F)c(F)c(C)c(F)c2Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
KDR P35968 2/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
MAPT P10636 4/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 1/20 0.44
MAOA P21397 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 2/20 0.42
NFKB1 P19838 2/20 0.42
RAB9A P51151 2/20 0.42
NFKB2 Q00653 2/20 0.42
RELA Q04206 2/20 0.42
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42

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
SCHEMBL4011479 0.87 SMN1; SMN2 (0.43) KDM4EKDRMEN1KMT2AMAPT
SCHEMBL4011473 0.84 SMN1; SMN2 (0.43) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL4015413 0.81 KDR (0.51) KDM4EKDRMEN1KMT2AMAPT
SCHEMBL4010154 0.79 KDR (0.53) KDM4EKDRMEN1KMT2AMAPT
SCHEMBL4010419 0.79 KDM4E (0.49) KDM4EKDRMEN1KMT2AMAPT
SCHEMBL4011490 0.78 KDR (0.49) KDM4EKDRMEN1KMT2AMAPT
SCHEMBL4010377 0.77 KDR (0.55) KDM4EKDRMEN1KMT2AMAPT
SCHEMBL4015144 0.76 BCHE (0.48) KDM4EKDRMAPTHTTHDAC1
SCHEMBL4015053 0.76 KDR (0.56) KDM4EKDRMEN1KMT2AMAPT
SCHEMBL4008188 0.75 BRD4 (0.61) KDM4EKDRMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558567-B1 NOVEL AMIDE COMPOUNDS WITH MCH ANTAGONISTIC EFFECT AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM PHARMA (DE) 2009-06-24 EP claimed