SCHEMBL19019693

SCHEMBL19019693

CCCCCCC(=NOC(=O)c1ccccc1)C(=O)c1ccc(Sc2ccccc2)cc1.CCn1c2ccc(C(=O)c3ccccc3C)cc2c2cc(C(C)=NOC(C)=O)ccc21

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.36
KDM4E B2RXH2 3/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 2/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
PKM P14618 1/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
PLA2G2A P14555 2/20 0.31
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL19042896 0.93 CNR2 (0.34) CNR2KDM4ELMNAMAPTHPGD
SCHEMBL23802488 0.90 CNR2 (0.33) CNR2KDM4ELMNAMAPTHPGD
SCHEMBL21938746 0.89 CNR2 (0.33) CNR2PPARGPPARA
SCHEMBL16556361 0.88 CNR2 (0.44) CNR2KDM4ELMNAMAPTHPGD
SCHEMBL11960281 0.86 CNR2 (0.41) CNR2KDM4ELMNAMAPTHPGD
SCHEMBL17070006 0.86 CNR2 (0.41) CNR2KDM4ELMNAMAPTHPGD
SCHEMBL12890838 0.83 CNR2 (0.40) CNR2KDM4ELMNAMAPTHPGD
SCHEMBL17069980 0.83 KMT2A (0.42) LMNAMAPTHTTKMT2AMEN1
SCHEMBL3209043 0.82 MAPT (0.47) CNR2KDM4ELMNAMAPTHPGD
SCHEMBL12629353 0.82 MAPT (0.47) CNR2KDM4ELMNAMAPTHPGD

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-3184568-A1 ACRYLATE-TERMINATED URETHANE POLYBUTADIENES FROM LOW-MONOMER 1:1 MONOADDUCTES FROM REACTIVE OLEFINIC COMPOUNDS AND DIISOCYANATES AND HYDROXY-TERMINATED POLYBUTADIENES FOR LIQUID OPTICALLY CLEAR ADHESIVES (LOCAS) Evonik Degussa GmbH (DE) 2017-06-28 EP claimed