SCHEMBL6798147

SCHEMBL6798147

CC(C)(C)[Si](C)(C)OCc1cccc(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.37
USP14 P54578 1/20 0.37
CYP3A4 P08684 2/20 0.36
IDO1 P14902 2/20 0.36
AGXT P21549 2/20 0.36
CNR1 P21554 11/20 0.35
CNR2 P34972 9/20 0.35
MAPT P10636 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
SCHEMBL6800371 0.89 AGXT (0.35) IDO1AGXTMAPT
SCHEMBL21367138 0.80 CYP3A4 (0.56) CYP3A4IDO1AGXTMAPT
SCHEMBL17030654 0.76 IDO1 (0.50) USP14IDO1AGXTMAPT
SCHEMBL6031606 0.76 TAAR1 (0.41) CYP3A4IDO1AGXT
SCHEMBL15687564 0.74 IDO1 (0.36) USP14CYP3A4IDO1AGXT
SCHEMBL840465 0.72 GABRA1 (0.45) CYP3A4MAPT
SCHEMBL11942311 0.72 IDO1 (0.38) CYP3A4IDO1AGXT
SCHEMBL722684 0.71 IDO1 (0.56) IDO1AGXT
SCHEMBL501378 0.71 MRGPRX4 (0.41) USP14IDO1
SCHEMBL631424 0.71 MAOB (0.42) CYP19A1CYP3A4IDO1AGXT

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-20040235816-A1 Azetidine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2004-11-25 US disclosed
US-20020035102-A1 Azetidine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2002-03-21 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 (2 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-20040235816-A1 Azetidine derivatives, their preparation and medicaments containing them AZI2, ADRA2A, ADRA2C CYP19A1 467/4885USP14 736/4885CYP3A4 68/4885
US-20020035102-A1 Azetidine derivatives, their preparation and medicaments containing them CYP11B2, AZI2, CYP2C19 CYP19A1 123/4885USP14 1708/4885CYP3A4 15/4885

“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.