SCHEMBL7983920

SCHEMBL7983920

O=C(NCCCC1CCN(CCCc2ccccc2)CC1)C1=Cc2cnc3cccc(n23)S1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.48
CCR3 P51677 4/20 0.43
SLC6A2 P23975 4/20 0.41
SLC6A4 P31645 4/20 0.41
DRD4 P21917 1/20 0.41
TMEM97 Q5BJF2 2/20 0.40
GRIN2B Q13224 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
LTA4H P09960 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
Hydrochloric Acid SCHEMBL7981637 0.99 CHRM4 (0.47) CHRM4CCR3SLC6A2SLC6A4DRD4
SCHEMBL7990681 0.96 CHRM4 (0.43) CHRM4CCR3SLC6A2SLC6A4TMEM97
SCHEMBL7989522 0.96 CHRM4 (0.53) CHRM4CCR3DRD4GRIN2BMAOA
Hydrochloric Acid SCHEMBL7989624 0.95 CHRM4 (0.42) CHRM4CCR3SLC6A2SLC6A4TMEM97
Hydrochloric Acid SCHEMBL7972385 0.95 CHRM4 (0.52) CHRM4CCR3DRD4GRIN2BMAOA
SCHEMBL7989700 0.91 CHRM4 (0.46) CHRM4MAOAMAOB
SCHEMBL7982426 0.91 LTA4H (0.47) CHRM4DRD4GRIN2BMAOAMAOB
SCHEMBL7985583 0.91 ALDH1A1 (0.43) CHRM4DRD4
Hydrochloric Acid SCHEMBL7986707 0.90 CHRM4 (0.46) CHRM4MAOAMAOB
Hydrochloric Acid SCHEMBL7971795 0.90 LTA4H (0.47) CHRM4DRD4GRIN2BMAOAMAOB

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