SCHEMBL11549306

SCHEMBL11549306

CCOC(C)(CC)CCCC(C)=CCO

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
MEN1 O00255 2/20 0.37
CYP3A4 P08684 2/20 0.37
ALOX15 P16050 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
UGT1A1 P22309 1/20 0.36
SQLE Q14534 2/20 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
SCHEMBL11549303 1.00 PTPN1 (0.41) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL11548980 0.95 PTPN1 (0.40) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL11548983 0.95 PTPN1 (0.40) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL11547248 0.87 SQLE (0.39) MEN1CYP3A4ALOX15KMT2AMAPT
SCHEMBL11546257 0.86 PTPN1 (0.41) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL11546263 0.86 PTPN1 (0.41) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL11550809 0.85
SCHEMBL11550812 0.85
SCHEMBL11549585 0.84 PTPN1 (0.39) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL11549588 0.84 PTPN1 (0.39) PTPN1MEN1CYP3A4ALOX15KMT2A

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