SCHEMBL11435239

SCHEMBL11435239

CCCCCCC(CCCC)NC=O

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 3/20 0.64
ADH1C P00326 3/20 0.64
ADH1A P07327 3/20 0.64
ADH7 P40394 3/20 0.64
ADH4 P08319 2/20 0.64
EPHX1 P07099 1/20 0.46
DNM1 Q05193 2/20 0.41
MAPT P10636 2/20 0.41
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PLA2G2C Q5R387 2/20 0.40
CA2 P00918 1/20 0.39
TRPA1 O75762 1/20 0.38
DDAH1 O94760 1/20 0.38
GAPDH P04406 1/20 0.38
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
FFAR1 O14842 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.37

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
SCHEMBL11110933 1.00 ADH1B (0.64) ADH1BADH1CADH1AADH7ADH4
SCHEMBL25693408 0.98 ADH1B (0.67) ADH1BADH1CADH1AADH7ADH4
SCHEMBL18558683 0.98 ADH1B (0.67) ADH1BADH1CADH1AADH7ADH4
SCHEMBL11111750 0.98 ADH1B (0.67) ADH1BADH1CADH1AADH7ADH4
SCHEMBL20835080 0.98 ADH1B (0.67) ADH1BADH1CADH1AADH7ADH4
SCHEMBL11450788 0.96 ADH1B (0.63) ADH1BADH1CADH1AADH7ADH4
SCHEMBL277537 0.94 ADH1B (0.62) ADH1BADH1CADH1AADH7ADH4
SCHEMBL10580815 0.94 ADH1B (0.62) ADH1BADH1CADH1AADH7ADH4
SCHEMBL6022099 0.94 ADH1B (0.62) ADH1BADH1CADH1AADH7ADH4
SCHEMBL8693236 0.93 ADH1B (0.54) ADH1BADH1CADH1AADH7ADH4

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-4217111-A REDUCING OCTANE REQUIREMENT CHEVRON RESEARCH COMPANY (US) 1980-08-12 US disclosed