SCHEMBL420147

SCHEMBL420147

O=Cc1ccc2c(c1)C[C@H](NC(=O)c1ccc(OCC3CC3)cn1)C2

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.72
BACE1 P56817 1/20 0.40
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
CNR2 P34972 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
HRH3 Q9Y5N1 2/20 0.36
ACACB O00763 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
ACACA Q13085 1/20 0.36

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
SCHEMBL420148 1.00 MCHR1 (0.72) MCHR1BACE1CYP4F2CYP4A11CNR2
SCHEMBL415260 0.86 MCHR1 (0.54) MCHR1
SCHEMBL415259 0.86 MCHR1 (0.54) MCHR1
SCHEMBL418820 0.86 MCHR1 (0.71) MCHR1
SCHEMBL418821 0.86 MCHR1 (0.71) MCHR1
SCHEMBL10083297 0.85 MCHR1 (0.82) MCHR1BACE1ACACB
SCHEMBL10083298 0.84 MCHR1 (1.00) MCHR1BACE1GPR119
SCHEMBL10083302 0.81 MCHR1 (0.82) MCHR1BACE1CNR2
SCHEMBL10083299 0.81 MCHR1 (0.77) MCHR1CYP3A4
SCHEMBL10083316 0.81 MCHR1 (0.76) MCHR1

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-8552199-B2 Substituted indanes, method for the production thereof, and use thereof as drugs SANOFI (FR) 2013-10-08 US disclosed
US-20120022039-A1 NOVEL SUBSTITUTED INDANES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS DRUGS SANOFI (FR) 2012-01-26 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-20120022039-A1 NOVEL SUBSTITUTED INDANES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS DRUGS MCHR1, MCHR2, IDO1 MCHR1 1/4885BACE1 3623/4885CYP4F2 282/4885

“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.