SCHEMBL7989283

SCHEMBL7989283

O=C(NCCCC1CCN(CCCc2ccccc2Cl)CC1)C1=Cc2cnc3cccc(n23)S1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
FAAH O00519 2/20 0.36
CCR3 P51677 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ACKR3 P25106 1/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
KCNH2 Q12809 2/20 0.35
DRD3 P35462 1/20 0.35

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 SCHEMBL7983317 0.99 CHRM4 (0.36) CHRM4SLC6A2SLC6A4MAOAMAOB
SCHEMBL7983846 0.96 KCNH2 (0.39) CHRM4SLC6A2SLC6A4MAOAMAOB
SCHEMBL7982308 0.96 CHRM4 (0.41) CHRM4MAOAMAOB
Hydrochloric Acid SCHEMBL7972053 0.95 CHRM4 (0.40) CHRM4MAOAMAOBKCNH2
Hydrochloric Acid SCHEMBL7981811 0.95 KCNH2 (0.40) CHRM4SLC6A2SLC6A4MAOAMAOB
SCHEMBL7986225 0.92 MAOA (0.42) CHRM4MAOAMAOBKCNH2
SCHEMBL7986666 0.92 TP53 (0.39) KCNH2
Hydrochloric Acid SCHEMBL7972048 0.91 TP53 (0.38) KCNH2
Hydrochloric Acid SCHEMBL7973072 0.91 KCNH2 (0.41) CHRM4MAOAMAOBKCNH2
SCHEMBL7983920 0.89 CHRM4 (0.48) CHRM4SLC6A2SLC6A4MAOAMAOB

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