SCHEMBL10095129

SCHEMBL10095129

O=C(I)CCCCCC(O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 1/20 0.48
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
RIPK1 Q13546 1/20 0.44
TBXAS1 P24557 1/20 0.44
CERT1 Q9Y5P4 3/20 0.43
LMNA P02545 2/20 0.42
BCAT2 O15382 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL11831229 0.85 ASAH1 (0.50) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL6907995 0.85 TBXAS1 (0.58) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL9308449 0.85 TBXAS1 (0.58) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL8942907 0.85 ASAH1 (0.50) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL11836011 0.85 ASAH1 (0.50) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL6907990 0.85 TBXAS1 (0.58) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL27820361 0.83 TBXAS1 (0.55) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL27585172 0.83 TBXAS1 (0.55) ASAH1HDAC1HDAC8RIPK1TBXAS1
SCHEMBL11828179 0.80 RIPK1 (0.61) RIPK1LMNABCAT2L3MBTL1KDM4E
SCHEMBL6392113 0.77 HDAC1 (0.67) HDAC1HDAC8KDM4E

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-8124778-B2 Tricyclic inhibitors of fatty acid amide hydrolase THE SCRIPPS RESEARCH INSTITUTE (US) 2012-02-28 US disclosed
US-20100216750-A1 TRICYCLIC INHIBITORS OF FATTY ACID AMIDE HYDROLASE THE SCRIPPS RESEARCH INSTITUTE (US) 2010-08-26 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-20100216750-A1 TRICYCLIC INHIBITORS OF FATTY ACID AMIDE HYDROLASE FADS1, FAAH, SCD ASAH1 55/4885HDAC1 129/4885HDAC8 214/4885

“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.