SCHEMBL6897804

SCHEMBL6897804

CCCCCS(=O)(=O)N1CCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.38
CA2 P00918 1/20 0.38
NPC1 O15118 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
RECQL P46063 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
GAA P10253 2/20 0.36
PKM P14618 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL6897801 1.00 FAAH (0.41) FAAHL3MBTL1CA2NPC1TSHR
SCHEMBL1069645 0.96 FAAH (0.41) FAAHL3MBTL1CA2NPC1TSHR
SCHEMBL6901401 0.96 FAAH (0.41) FAAHL3MBTL1CA2NPC1TSHR
SCHEMBL24767441 0.94 FAAH (0.45) FAAHL3MBTL1CA2TSHRMAPK1
SCHEMBL2817480 0.94 L3MBTL1 (0.42) FAAHL3MBTL1CA2TSHRMAPK1
SCHEMBL6894873 0.94 L3MBTL1 (0.42) FAAHL3MBTL1CA2TSHRMAPK1
SCHEMBL18937755 0.92 FAAH (0.43) FAAHL3MBTL1CA2TSHRMAPK1
SCHEMBL7863051 0.92 FAAH (0.43) FAAHL3MBTL1CA2TSHRMAPK1
SCHEMBL10722736 0.89 FAAH (0.48) FAAHL3MBTL1CA2ALDH1A1GAA
SCHEMBL7122564 0.89 FAAH (0.48) FAAHL3MBTL1CA2ALDH1A1GAA

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-6734311-B2 ANTIINFLAMMATORY AGENTS; ALZHEIMER'S DISEASE; CARDIOVASCULAR DISORDERS MERCK & CO., INC. 2004-05-11 US disclosed
US-20030092746-A1 Substituted amidine derivatives as inhibitors of cell adhesion MERCK & CO., INC. 2003-05-15 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-20030092746-A1 Substituted amidine derivatives as inhibitors of cell adhesion VCAM1, CD4, ICAM1 FAAH 795/4885L3MBTL1 2016/4885CA2 4710/4885

“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.