SCHEMBL6714714

SCHEMBL6714714

CN(C)CCn1c(Cc2ccccc2)nc2cc(NC(=O)Nc3ccc(Oc4ccccc4)cc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.52
CNR1 P21554 2/20 0.51
BCHE P06276 1/20 0.48
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
RECQL P46063 1/20 0.46
MCHR2 Q969V1 2/20 0.45
MCHR1 Q99705 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GLA P06280 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPK14 Q16539 1/20 0.45
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
JAK3 P52333 1/20 0.45

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
SCHEMBL6719936 0.87 MAPT (0.54) NPC1RAB9ASMN1; SMN2MCHR2MCHR1
SCHEMBL6719308 0.85 MAPK14 (0.48) NPC1RAB9AMCHR2MCHR1MAPT
SCHEMBL6716133 0.79 HTR6 (0.55) MCHR2MCHR1HTTMAPK14
SCHEMBL6763924 0.78 KMT2A (0.52) NPC1RAB9ASMN1; SMN2MCHR2MCHR1
SCHEMBL6711939 0.78 POLB (0.50) MCHR2MCHR1MAPK14
SCHEMBL6716484 0.76 MCHR1 (0.63) CNR2NPC1RAB9ASMN1; SMN2RECQL
SCHEMBL6070000 0.76 MCHR1 (0.71) MCHR2MCHR1
SCHEMBL5862841 0.76 MCHR1 (0.60) MCHR2MCHR1MAPK14
SCHEMBL6714734 0.76 HTR6 (0.54) MCHR2MCHR1MAPK14
SCHEMBL27605937 0.76 NPC1 (0.56) NPC1RAB9ASMN1; SMN2RECQLMCHR2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1555260-A Aminoalkyl-substituted aromatic bicyclic compounds, process for their preparation and their use as pharmaceuticals ���ĵ�˹ҩ��¹����޹�˾ 2004-12-15 CN disclosed
US-20040198731-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-07 US disclosed
US-20040198732-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-07 US disclosed
US-20040198733-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-07 US disclosed
US-20040192693-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-09-30 US disclosed
US-20030212070-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-11-13 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 (5 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-20030212070-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC CNR2 2/4885CNR1 6/4885BCHE 542/4885
US-20040192693-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC CNR2 2/4885CNR1 6/4885BCHE 542/4885
US-20040198731-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC CNR2 2/4885CNR1 6/4885BCHE 542/4885
US-20040198733-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC CNR2 2/4885CNR1 6/4885BCHE 542/4885
US-20040198732-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC CNR2 2/4885CNR1 6/4885BCHE 542/4885

“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.