SCHEMBL11547600

SCHEMBL11547600

CCC(C)=CCCCC(C)=CCBr

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SQLE Q14534 5/20 0.38
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
UGT1A1 P22309 1/20 0.33
KDM1A O60341 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LSS P48449 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
SCHEMBL11547598 1.00 SQLE (0.38) SQLEKMT2AMAPTALDH1A1MEN1
SCHEMBL11547922 0.88 SQLE (0.38) SQLEKMT2AMAPTALDH1A1MEN1
SCHEMBL11547920 0.88 SQLE (0.38) SQLEKMT2AMAPTALDH1A1MEN1
SCHEMBL11549692 0.87 KMT2A (0.50) SQLEKMT2AMAPTALDH1A1MEN1
SCHEMBL11549688 0.87 KMT2A (0.50) SQLEKMT2AMAPTALDH1A1MEN1
SCHEMBL755511 0.82
SCHEMBL755510 0.82
SCHEMBL11546067 0.81 KMT2A (0.54) SQLEKMT2AMAPTALDH1A1MEN1
SCHEMBL11554841 0.81 SQLE (0.48) SQLEKMT2AMAPTALDH1A1MEN1
SCHEMBL11546064 0.81 KMT2A (0.54) SQLEKMT2AMAPTALDH1A1MEN1

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
US-4137273-A INSECTICIDES, CHEMICAL INTERMEDIATES ZOECON CORPORATION (US) 1979-01-30 US disclosed