SCHEMBL3775772

SCHEMBL3775772

CC(C)(C)OC(=O)NC1(C(=O)Nc2ccc(C=CC(=O)O)cc2)CCC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 6/20 0.48
GHSR Q92847 1/20 0.46
TRPV1 Q8NER1 4/20 0.45
CYP3A4 P08684 11/20 0.44
CYP2C19 P33261 10/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HPGD P15428 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
SCHEMBL3775768 1.00 FAAH (0.48) FAAHGHSRTRPV1CYP3A4CYP2C19
SCHEMBL3071576 0.98 FAAH (0.51) FAAHGHSRTRPV1CYP3A4CYP2C19
SCHEMBL3071572 0.98 FAAH (0.51) FAAHGHSRTRPV1CYP3A4CYP2C19
SCHEMBL772183 0.86 GHSR (0.46) FAAHGHSRTRPV1CYP3A4ALDH1A1
SCHEMBL2156573 0.84 GHSR (0.46) FAAHGHSRTRPV1CYP3A4CYP2C19
SCHEMBL5065679 0.84 GHSR (0.46) FAAHGHSRTRPV1CYP3A4CYP2C19
SCHEMBL13476046 0.83 CYP3A4 (0.49) FAAHTRPV1CYP3A4CYP2C19CYP1A2
SCHEMBL25384603 0.83 FAAH (0.62) FAAHGHSRTRPV1ALDH1A1HPGD
SCHEMBL27658921 0.83 FAAH (0.49) FAAHGHSRTRPV1CYP3A4CYP2C19
SCHEMBL16512496 0.82 FAAH (0.53) FAAHGHSRTRPV1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206715-A1 Fused heterotetracyclic compounds and use thereof as hcv polymerase inhibitor Japan Tobacco, Inc. (JP) 2010-07-14 EP disclosed
EP-1719773-B1 FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC (JP) 2009-04-15 EP disclosed
US-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2007-03-01 US disclosed
EP-1719773-A1 FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR Japan Tobacco, Inc. (JP) 2006-11-08 EP 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-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor POLI, TERT, ZC3HAV1 FAAH 3682/4885GHSR 4302/4885TRPV1 4075/4885

“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.