SCHEMBL3391176

SCHEMBL3391176

Cc1n[nH]c(C)c1C(=O)N[C@H]1CCc2ccccc2C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.56
MTNR1B P49286 5/20 0.56
ADORA2A P29274 1/20 0.44
P2RX7 Q99572 1/20 0.43
FAAH O00519 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CHRM4 P08173 1/20 0.42
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
BCL2 P10415 1/20 0.41
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
BCL2A1 Q16548 1/20 0.41
TAOK1 Q7L7X3 1/20 0.41
RIPK1 Q13546 1/20 0.40
SYK P43405 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL6510668 1.00 MTNR1A (0.56) MTNR1AMTNR1BADORA2AP2RX7FAAH
SCHEMBL3394393 0.77 MTNR1A (0.54) MTNR1AMTNR1BADORA2AMAOAMAOB
SCHEMBL3391180 0.76 P2RX7 (0.69) P2RX7NPC1LMNARAB9A
SCHEMBL6510673 0.76 P2RX7 (0.69) P2RX7NPC1LMNARAB9A
SCHEMBL3395358 0.75 MTNR1A (0.55) MTNR1AMTNR1BADORA2ACHRM4NPC1
SCHEMBL6515879 0.75 MTNR1A (0.55) MTNR1AMTNR1BADORA2ACHRM4NPC1
SCHEMBL14335611 0.75 MTNR1A (0.61) MTNR1AMTNR1BADORA2AMAOAMAOB
SCHEMBL24131083 0.74 TAS1R3 (0.53) NPC1LMNARAB9A
SCHEMBL3392158 0.74 MTNR1A (0.57) MTNR1AMTNR1BADORA2AP2RX7NPC1
SCHEMBL3423865 0.74 MTNR1A (0.57) MTNR1AMTNR1BADORA2AP2RX7NPC1

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
EP-1370530-B1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL SANOFI AVENTIS DEUTSCHLAND (DE) 2010-12-29 EP disclosed
US-6949556-B2 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-09-27 US disclosed
EP-1370530-A1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL Aventis Pharma Deutschland GmbH (DE) 2003-12-17 EP disclosed
US-20030022935-A1 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-01-30 US disclosed
WO-2002064565-A1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-08-22 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-20030022935-A1 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents VEGFA, EDNRA, NR1H2 MTNR1A 604/4885MTNR1B 448/4885ADORA2A 1717/4885

“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.