SCHEMBL18251813

SCHEMBL18251813

CCCC[C@H](C)CCCC[C@H](C)C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACE2 Q9BYF1 1/20 0.81
▸ BLM P54132 1/20 0.67
▸ CA1 P00915 2/20 0.52
▸ LTA4H P09960 1/20 0.50
▸ CA2 P00918 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ GPR84 Q9NQS5 3/20 0.47
▸ FFAR1 O14842 1/20 0.47
▸ GABRR1 P24046 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ LCK P06239 1/20 0.45
▸ PPARD Q03181 1/20 0.45
▸ ZDHHC20 Q5W0Z9 1/20 0.45
▸ ZDHHC2 Q9UIJ5 1/20 0.45

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
SCHEMBL12970846 0.98 ACE2 (0.85) ACE2BLMCA1LTA4HCA2
SCHEMBL5879029 0.98 ACE2 (0.85) ACE2BLMCA1LTA4HCA2
SCHEMBL5879024 0.98 ACE2 (0.85) ACE2BLMCA1LTA4HCA2
SCHEMBL5878822 0.98 ACE2 (0.85) ACE2BLMCA1LTA4HCA2
SCHEMBL5878913 0.94 ACE2 (0.92) ACE2BLMCA1LTA4HGPR84
SCHEMBL5879047 0.94 ACE2 (0.92) ACE2BLMCA1LTA4HGPR84
SCHEMBL5879079 0.94 ACE2 (0.92) ACE2BLMCA1LTA4HGPR84
SCHEMBL5878803 0.94 ACE2 (0.92) ACE2BLMCA1LTA4HGPR84
SCHEMBL5879028 0.94 ACE2 (0.92) ACE2BLMCA1LTA4HGPR84
SCHEMBL6294130 0.94 ACE2 (0.92) ACE2BLMCA1LTA4HGPR84

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10023610-B2 Ligands for prevention of neurotoxicity of the alzheimer's disease related amyloid-beta peptide ALPHABETA AB (SE) 2018-07-17 — — US disclosed
US-20160340387-A1 NOVEL LIGANDS FOR PREVENTION OF NEUROTOXICITY OF THE ALZHEIMER'S DISEASE RELATED AMYLOID-BETA PEPTIDE ALPHABETA AB (SE) 2016-11-24 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10023610-B2 Ligands for prevention of neurotoxicity of the alzheimer's disease related amyloid-beta peptide APP, BACE1, PSEN1 ACE2 895/4885BLM 3687/4885CA1 490/4885
US-20160340387-A1 NOVEL LIGANDS FOR PREVENTION OF NEUROTOXICITY OF THE ALZHEIMER'S DISEASE RELATED AMYLOID-BETA PEPTIDE APP, BACE1, PSEN1 ACE2 932/4885BLM 4087/4885CA1 639/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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