SCHEMBL7986487

SCHEMBL7986487

CCc1ccc(CCCN2CCC(CNC(=O)C3=Cc4cnc5cccc(n45)S3)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.42
CCR3 P51677 1/20 0.40
HTR4 Q13639 5/20 0.39
GRIN2B Q13224 1/20 0.38
KDM1A O60341 6/20 0.37
HDAC6 Q9UBN7 5/20 0.37
HDAC3 O15379 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
KCNH2 Q12809 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC9 Q9UKV0 1/20 0.37
HDAC5 Q9UQL6 1/20 0.37
NCOR2 Q9Y618 1/20 0.37
HTR2A P28223 3/20 0.37

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 SCHEMBL7987154 0.99 LTA4H (0.41) LTA4HCCR3HTR4GRIN2BKDM1A
SCHEMBL7982426 0.93 LTA4H (0.47) LTA4HHTR4GRIN2BKDM1AHDAC6
SCHEMBL7989275 0.92 CCR3 (0.47) LTA4HCCR3GRIN2BKDM1AHDAC6
SCHEMBL7972913 0.92 LTA4H (0.42) LTA4HCCR3HTR4GRIN2BKDM1A
Hydrochloric Acid SCHEMBL7986708 0.92 LTA4H (0.44) LTA4HCCR3HTR4GRIN2BKDM1A
Hydrochloric Acid SCHEMBL7971795 0.92 LTA4H (0.47) LTA4HHTR4GRIN2BKDM1AHDAC6
SCHEMBL7972589 0.91 GSK3B (0.46) LTA4HCCR3HTR4KDM1AHDAC6
Hydrochloric Acid SCHEMBL7982374 0.91 KDM1A (0.41) LTA4HCCR3HTR4GRIN2BKDM1A
Hydrochloric Acid SCHEMBL7986155 0.91 CCR3 (0.47) LTA4HCCR3GRIN2BKDM1AHDAC6
SCHEMBL7990607 0.91 GRIN2B (0.41) LTA4HCCR3HTR4GRIN2BKDM1A

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