SCHEMBL7675040

SCHEMBL7675040

CC(O)C1CCCCCC1=O.CCCCC(O)C1CC(C)CCC1=O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 7/20 0.37
CTSD P07339 2/20 0.37
CYP2D6 P10635 1/20 0.35
KMT2A Q03164 1/20 0.33
TLR4 O00206 1/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
MMP1 P03956 1/20 0.30
MMP7 P09237 1/20 0.30
MMP12 P39900 1/20 0.30
ECE1 P42892 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL6906656 0.87 TLR4 (0.39) TLR4
SCHEMBL1238048 0.82 CYP2D6 (0.44) CYP2D6KMT2ACA1CA2CA4
SCHEMBL1238202 0.78 CYP2D6 (0.43) CYP2D6
SCHEMBL913008 0.77 CYP2D6 (0.39) CYP2D6
SCHEMBL11903954 0.76 CYP2D6 (0.43) CYP2D6
SCHEMBL7632295 0.76 KMT2A (0.48) CYP2D6KMT2ACA1CA2CA4
SCHEMBL6906311 0.76 KMT2A (0.48) CYP2D6KMT2ACA1CA2CA4
SCHEMBL6907712 0.76 KMT2A (0.48) CYP2D6KMT2ACA1CA2CA4
SCHEMBL6907608 0.76 KMT2A (0.48) CYP2D6KMT2ACA1CA2CA4
SCHEMBL6907464 0.74 CYP2D6 (0.46) CYP2D6KMT2ACA1CA2CA4

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-20020143070-A1 Noxious-insect repellent KANEBO, LTD. 2002-10-03 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-20020143070-A1 Noxious-insect repellent OPRM1, OPRD1, L3MBTL1 BACE1 1347/4885CTSD 4501/4885CYP2D6 1959/4885

“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.