SCHEMBL28867445

SCHEMBL28867445

CCCCCC(C)CCCCCC(C)CC(O)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.50
SPHK1 Q9NYA1 2/20 0.45
GPR84 Q9NQS5 8/20 0.42
FFAR1 O14842 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
LMNA P02545 2/20 0.40
PRKD3 O94806 1/20 0.40
PRKCG P05129 1/20 0.40
PRKCB P05771 1/20 0.40
PRKCA P17252 1/20 0.40
PRKCH P24723 1/20 0.40
PRKCI P41743 1/20 0.40
PRKCE Q02156 1/20 0.40
PRKCQ Q04759 1/20 0.40
PRKCZ Q05513 1/20 0.40
PRKCD Q05655 1/20 0.40
PRKD1 Q15139 1/20 0.40
MAPT P10636 2/20 0.39
CYP2D6 P10635 2/20 0.38
GMNN O75496 1/20 0.38

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
SCHEMBL26103818 0.96 ACE2 (0.44) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL26100730 0.89 ALDH1A1 (0.39) ACE2SPHK1GPR84CYP3A4
SCHEMBL6575633 0.87 GPR84 (0.50) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL28472252 0.87 ACE2 (0.53) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL4760260 0.87 GPR84 (0.50) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL27553114 0.87 ACE2 (0.53) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL6768549 0.87 GPR84 (0.50) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL9583241 0.87 GPR84 (0.50) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL13483766 0.85 ACE2 (0.47) ACE2SPHK1GPR84FFAR1FFAR4
SCHEMBL13483767 0.85 GPR84 (0.48) ACE2SPHK1GPR84FFAR1FFAR4

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
CN-109081774-A The preparation method of a plant ketone 浙江医药股份有限公司昌海生物分公司 2018-12-25 CN disclosed