SCHEMBL24021971

SCHEMBL24021971

CCCCCCCCCCOC(=O)C(CC(=O)O)NCCCN(CCCC)CCCC

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 12/20 0.41
KDM5A P29375 2/20 0.41
PHF8 Q9UPP1 2/20 0.41
KDM4C Q9H3R0 1/20 0.41
EPHX2 P34913 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX1 P07099 1/20 0.39

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
SCHEMBL5359782 0.88 CHRM2 (0.41) ACHEEPHX2SMN1; SMN2
SCHEMBL17117556 0.80 ACHE (0.44) ACHE
SCHEMBL13092685 0.79 DNM1 (0.48) ACHEEPHX1
SCHEMBL30872097 0.77 EPHX1 (0.45) ACHEEPHX1
SCHEMBL8084072 0.77 EPHX2 (0.41) ACHEEPHX2
SCHEMBL1801127 0.77 CHRM2 (0.38) ACHESMN1; SMN2EPHX1
SCHEMBL27812694 0.76 EPHX1 (0.44) ACHEEPHX1
SCHEMBL9506389 0.76 KDM5A (0.40) KDM5APHF8KDM4CEPHX2
SCHEMBL7179665 0.75 EPHX1 (0.49) ACHEEPHX2NPC1RAB9ASMN1; SMN2
Trolamine SCHEMBL27175300 0.75 EPHX2 (0.41) KDM5APHF8KDM4CEPHX2NPC1

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-11174235-B2 Carboxy alkyl-ester anti-agglomerants for the control of natural gas hydrates CHAMPIONX USA INC. (US) 2021-11-16 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 (1 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-11174235-B2 Carboxy alkyl-ester anti-agglomerants for the control of natural gas hydrates H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, AQP1, AQP3 ACHE 923/4885KDM5A 2954/4885PHF8 875/4885

“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.