SCHEMBL415259

SCHEMBL415259

O=Cc1ccc2c(c1)C[C@H](NC(=O)c1ccc(OCC3CC3)cc1)C2

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.54
NR1H4 Q96RI1 1/20 0.47
PARP15 Q460N3 2/20 0.45
PARP10 Q53GL7 2/20 0.45
PARP2 Q9UGN5 2/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL415260 1.00 MCHR1 (0.54) MCHR1NR1H4PARP15PARP10PARP2
SCHEMBL354944 0.93 MCHR1 (0.47) MCHR1NR1H4PARP15PARP10PARP2
SCHEMBL354945 0.93 MCHR1 (0.47) MCHR1NR1H4PARP15PARP10PARP2
SCHEMBL420147 0.86 MCHR1 (0.72) MCHR1
SCHEMBL420148 0.86 MCHR1 (0.72) MCHR1
SCHEMBL420200 0.85 MCHR1 (0.69) MCHR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL420199 0.85 MCHR1 (0.69) MCHR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL420113 0.84 MCHR1 (0.51) MCHR1NR1H4PARP15PARP10PARP2
SCHEMBL420114 0.84 MCHR1 (0.51) MCHR1NR1H4PARP15PARP10PARP2
SCHEMBL356088 0.79 TAOK1 (0.60)

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
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
EP-2396298-A1 NOVEL SUBSTITUTED INDANES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS DRUGS SANOFI (FR) 2011-12-21 EP disclosed
WO-2010092154-A1 NOVEL SUBSTITUTED INDANES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS DRUGS SANOFI-AVENTIS (FR) 2010-08-19 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-20120022039-A1 NOVEL SUBSTITUTED INDANES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS DRUGS MCHR1, MCHR2, IDO1 MCHR1 1/4885NR1H4 159/4885PARP15 1854/4885

“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.