SCHEMBL9539337

SCHEMBL9539337

CCCCCCC(C)CCC(C)C1(C)CCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.44
PRKD3 O94806 1/20 0.33
PRKCG P05129 1/20 0.33
PRKCB P05771 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCH P24723 1/20 0.33
PRKCI P41743 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCZ Q05513 1/20 0.33
PRKCD Q05655 1/20 0.33
PRKD1 Q15139 1/20 0.33
OPRM1 P35372 1/20 0.33
SPHK1 Q9NYA1 1/20 0.32
LMNA P02545 2/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31

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
SCHEMBL8517438 0.78 OPRM1 (0.42) ACE2OPRM1SPHK1LMNAADH1B
SCHEMBL19366523 0.76 ACE2 (0.42) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL31187915 0.76 ACE2 (0.67) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL995479 0.76 ACE2 (0.67) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL20835139 0.73 ACE2 (0.62) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL22129693 0.73 ACE2 (0.62) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL20506768 0.73 ACE2 (0.62) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL20506755 0.73 ACE2 (0.62) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL21086628 0.73 ACE2 (0.62) ACE2PRKD3PRKCGPRKCBPRKCA
SCHEMBL20506761 0.73 ACE2 (0.62) ACE2PRKD3PRKCGPRKCBPRKCA

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
WO-1993002156-A1 PARAFFIN ISOMERIZATION PROCESS MOBIL OIL CORPORATION (US) 1993-02-04 WO disclosed