SCHEMBL3140214

SCHEMBL3140214

COc1cccc(CCCCCCC(O[Si](C)(C)C(C)(C)C)c2ncco2)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HTR1A P08908 1/20 0.38
IDO1 P14902 2/20 0.36
AGXT P21549 2/20 0.36
FAAH O00519 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
NR3C2 P08235 1/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
ABCB1 P08183 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
SCHEMBL3133263 0.86 FAAH (0.42) FAAH
SCHEMBL3145194 0.82 HDAC1 (0.38) CHRM2CHRM1CHRM3HDAC1HDAC6
SCHEMBL3136724 0.82 HDAC1 (0.46) CHRM2CHRM1CHRM3HDAC1HDAC6
SCHEMBL1471592 0.76 FAAH (0.56) FAAH
SCHEMBL1471365 0.76 FAAH (0.56) FAAH
SCHEMBL2162516 0.72 FAAH (0.38) FAAH
SCHEMBL1471729 0.71 FAAH (0.53) HDAC1HDAC6FAAH
SCHEMBL21002124 0.69 TAAR1 (0.69) CHRM2CHRM1CHRM3HDAC1HDAC6
SCHEMBL2163301 0.69 CES1 (0.42) FAAH
SCHEMBL2162945 0.69 DAGLA (0.38) FAAH

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-8268817-B2 Substituted oxazole ketone modulators of fatty acid amide hydrolase THE SCRIPPS RESEARCH INSTITUTE (US) 2012-09-18 US disclosed
US-20100075931-A1 Substituted oxazole ketone modulators of fatty acid amide hydrolase THE SCRIPPS RESEARCH INSTITUTE (US) 2010-03-25 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-20100075931-A1 Substituted oxazole ketone modulators of fatty acid amide hydrolase FAAH, FAAH2, HCRTR2 CHRM2 4301/4885CHRM1 3956/4885CHRM3 3665/4885

“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.