SCHEMBL7989610

SCHEMBL7989610

CC(C)(C)OC(=O)N1CCN(CCNC(=O)C2=Cc3cnc4cccc(n34)S2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 3/20 0.50
LMNA P02545 8/20 0.42
TGFBR1 P36897 1/20 0.41
TGFBR2 P37173 1/20 0.41
TP53 P04637 5/20 0.41
MAPT P10636 3/20 0.41
MAPK14 Q16539 1/20 0.40
THRB P10828 3/20 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
SCHEMBL7985797 0.95 ACKR3 (0.51) ACKR3LMNATP53MAPTTHRB
SCHEMBL7989896 0.92 ACKR3 (0.49) ACKR3LMNATP53MAPTTHRB
SCHEMBL7987167 0.87 KDM4E (0.45) LMNATP53MAPT
SCHEMBL7984557 0.85 ACKR3 (0.40) ACKR3LMNATP53MAPTTHRB
SCHEMBL7981738 0.84 KDM4E (0.55) ACKR3LMNATGFBR1TP53MAPT
SCHEMBL8527068 0.82 L3MBTL1 (0.48)
Hydrochloric Acid SCHEMBL7986275 0.81 KDM4E (0.50)
SCHEMBL7972040 0.80 SIGMAR1 (0.40)
Hydrochloric Acid SCHEMBL7982606 0.79 FAAH (0.39)
SCHEMBL7972317 0.78 DRD2 (0.42)

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