SCHEMBL11744239

SCHEMBL11744239

ClCC=CCC1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.42
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30
ADH4 P08319 1/20 0.30
ADH7 P40394 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
SCHEMBL11744216 1.00 TDP1 (0.42) TDP1ADH1BADH1CADH1AADH4
SCHEMBL9450341 0.97 TDP1 (0.40) TDP1ADH1BADH1CADH1AADH4
SCHEMBL9450329 0.97 TDP1 (0.40) TDP1ADH1BADH1CADH1AADH4
SCHEMBL29860701 0.86 ADH1B (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9719598 0.74 ADH1B (0.34) ADH1BADH1CADH1AADH4ADH7
SCHEMBL10870592 0.74 ADH1B (0.30) ADH1BADH1CADH1AADH4ADH7
SCHEMBL28216071 0.72 ADH1B (0.37) ADH1BADH1CADH1AADH4ADH7
SCHEMBL10768135 0.72 ADH1B (0.33) ADH1BADH1CADH1AADH4ADH7
SCHEMBL8769980 0.72 ADH1B (0.33) ADH1BADH1CADH1AADH4ADH7
SCHEMBL6986477 0.72 ADH1B (0.33) ADH1BADH1CADH1AADH4ADH7

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-4036896-A FREE RADICAL CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1977-07-19 US disclosed