SCHEMBL4164840

SCHEMBL4164840

CCCN1C(=O)C2CC(Br)C(Br)CC2C1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RAB9A P51151 1/20 0.32
ESR1 P03372 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CNR2 P34972 3/20 0.30
CNR1 P21554 1/20 0.30
USP2 O75604 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 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
SCHEMBL23204888 0.82 CYP19A1 (0.36) CYP19A1SMN1; SMN2ALDH1A1KDM4EMEN1
SCHEMBL14198619 0.78
SCHEMBL14197808 0.76 KMT2A (0.33) KMT2A
SCHEMBL7487859 0.75 SMN1; SMN2 (0.50) CYP19A1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL29324951 0.75 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL17549818 0.75 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL8295802 0.74 CYP19A1 (0.42) CYP19A1SMN1; SMN2ALDH1A1KDM4EMEN1
SCHEMBL7481753 0.72 PTGS1 (0.52) CYP19A1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL7482405 0.72 PTGS1 (0.52) CYP19A1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL7490240 0.72 PTGS1 (0.52) CYP19A1SMN1; SMN2ALDH1A1MEN1KMT2A

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-2074253-A2 TEXTILE PRODUCT WITH FLAME RETARDED BACK-COATING AND METHOD OF MAKING THE SAME Albemarle Europe Sprl. (BE) 2009-07-01 EP disclosed