SCHEMBL7989146

SCHEMBL7989146

O=C(NCC1CCN(CCOc2ccccc2)CC1)C1=Cc2cnc3cccc(n23)S1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 7/20 0.49
KDM1A O60341 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
LTA4H P09960 1/20 0.40
HTR4 Q13639 1/20 0.39
HRH1 P35367 1/20 0.39
DRD2 P14416 2/20 0.39

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
Hydrochloric Acid SCHEMBL7983742 0.99 HTR7 (0.49) HTR7KDM1AHDAC6TMEM97SIGMAR1
SCHEMBL7986053 0.96 HTR7 (0.45) HTR7KDM1ATMEM97SIGMAR1LTA4H
Hydrochloric Acid SCHEMBL7982388 0.95 HTR7 (0.44) HTR7KDM1ATMEM97SIGMAR1LTA4H
SCHEMBL7984555 0.95 HTR7 (0.44) HTR7KDM1ATMEM97SIGMAR1LTA4H
Hydrochloric Acid SCHEMBL7986198 0.94 HTR7 (0.44) HTR7KDM1ATMEM97SIGMAR1LTA4H
SCHEMBL7983159 0.93 HTR7 (0.43) HTR7KDM1AHDAC6DRD2
Hydrochloric Acid SCHEMBL7986997 0.92 HTR7 (0.42) HTR7KDM1AHDAC6DRD2
SCHEMBL7971992 0.91 HTR7 (0.49) HTR7KDM1AHDAC6HTR4HRH1
Hydrochloric Acid SCHEMBL7985853 0.90 HTR7 (0.48) HTR7KDM1AHDAC6HTR4HRH1
SCHEMBL7971626 0.89 HTR7 (0.44) HTR7KDM1AHDAC6DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed
EP-0915888-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS Takeda Chemical Industries, Ltd. (JP) 1999-05-19 EP disclosed
WO-1997040051-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-30 WO disclosed