SCHEMBL18907913

SCHEMBL18907913

CCCCOc1ccc(F)cc1[C@H](COC(=O)CCC)OCCO

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.37
FAAH O00519 2/20 0.37
PPARG P37231 2/20 0.35
CYSLTR2 Q9NS75 5/20 0.35
CYSLTR1 Q9Y271 5/20 0.35
MGLL Q99685 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL18821417 0.91 PPARG (0.37) CNR2FAAHPPARGCYSLTR2CYSLTR1
SCHEMBL18972304 0.87 SLC6A9 (0.43) PPARG
SCHEMBL18907696 0.87 FAAH (0.38) CNR2FAAHPPARGCYSLTR2CYSLTR1
SCHEMBL18961618 0.84 SMN1; SMN2 (0.34) CNR2MGLLALDH1A1TDP1
SCHEMBL18907918 0.81 PTGDR2 (0.34) PPARGCYSLTR2CYSLTR1
SCHEMBL18908287 0.79 SMN1; SMN2 (0.34) FAAH
SCHEMBL18821425 0.78 SLC6A9 (0.42) PPARGALDH1A1L3MBTL1
SCHEMBL18914272 0.76 ALOX15 (0.36)
SCHEMBL18883443 0.75 SMN1; SMN2 (0.33) ALDH1A1TDP1
SCHEMBL18894946 0.74 KDM4E (0.37)

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-20170166584-A1 TRIAZOLE ACC INHIBITORS AND USES THEREOF Nimbus Apollo, Inc. 2017-06-15 US disclosed
WO-2017091617-A1 TRIAZOLE ACC INHIBITORS AND USES THEREOF GILEAD APOLLO, LLC (US) 2017-06-01 WO 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-20170166584-A1 TRIAZOLE ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT1 CNR2 3672/4885FAAH 1025/4885PPARG 371/4885

“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.