SCHEMBL10083293

SCHEMBL10083293

O=C(N[C@@H]1Cc2ccc(CN3CCCCCC3)cc2C1)c1ccc(OC[C@@H]2CCCO2)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 1.00
NPC1 O15118 2/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HRH3 Q9Y5N1 2/20 0.43
PRKAA2 P54646 3/20 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
SCHEMBL13945214 0.94 MCHR1 (0.90) MCHR1NPC1RAB9ASMN1; SMN2HRH3
SCHEMBL13129528 0.94 MCHR1 (0.90) MCHR1NPC1RAB9ASMN1; SMN2HRH3
SCHEMBL13129578 0.94 MCHR1 (0.90) MCHR1NPC1RAB9ASMN1; SMN2HRH3
SCHEMBL13129527 0.94 MCHR1 (0.88) MCHR1NPC1RAB9ASMN1; SMN2HRH3
SCHEMBL10083288 0.92 MCHR1 (0.84) MCHR1NPC1RAB9ASMN1; SMN2PRKAA2
SCHEMBL13129511 0.88 MCHR1 (0.79) MCHR1NPC1RAB9ASMN1; SMN2PRKAA2
SCHEMBL10083274 0.88 MCHR1 (0.83) MCHR1NPC1RAB9ASMN1; SMN2
SCHEMBL10083299 0.87 MCHR1 (0.77) MCHR1PRKAA2
SCHEMBL13129518 0.86 MCHR1 (0.76) MCHR1NPC1RAB9ASMN1; SMN2PRKAA2
SCHEMBL13129510 0.86 MCHR1 (0.76) MCHR1NPC1RAB9ASMN1; SMN2PRKAA2

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 5 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-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
US-20120022039-A1 NOVEL SUBSTITUTED INDANES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS DRUGS SANOFI (FR) 2012-01-26 US 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 1/4885NPC1 696/4885RAB9A 4438/4885

“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.