SCHEMBL7423982

SCHEMBL7423982

CC(C)(CCC(=O)OCc1ccccc1)OC(=O)NN1C(=O)CCc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER3 P43115 1/20 0.38
PTGER2 P43116 1/20 0.38
POLB P06746 1/20 0.37
TMEM97 Q5BJF2 2/20 0.37
SIGMAR1 Q99720 2/20 0.37
AVPR2 P30518 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ACHE P22303 1/20 0.36
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL7416761 0.86 POLB (0.41) L3MBTL1NPC1RAB9APOLBLMNA
SCHEMBL7420002 0.84 POLB (0.40) NOTUML3MBTL1NPC1RAB9APTGER1
SCHEMBL7421747 0.84 L3MBTL1 (0.41) NOTUML3MBTL1POLBLMNA
SCHEMBL7423680 0.82 L3MBTL1 (0.52) NOTUML3MBTL1NPC1RAB9APTGER1
SCHEMBL7414937 0.82 L3MBTL1 (0.42) NOTUML3MBTL1NPC1RAB9APTGER1
SCHEMBL7418469 0.79 L3MBTL1 (0.40) L3MBTL1POLBLMNA
SCHEMBL5638613 0.78 L3MBTL1 (0.49) L3MBTL1POLB
SCHEMBL9196586 0.77 L3MBTL1 (0.39) L3MBTL1NPC1RAB9APTGER1PTGER4
SCHEMBL18826684 0.71 ALDH1A1 (0.56) NOTUML3MBTL1NPC1RAB9APOLB
SCHEMBL9200822 0.71 POLB (0.45) NOTUML3MBTL1NPC1RAB9APTGER1

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-5594006-A SUCH AS COLLEGENASE, STROMELYSIN; ANTICANCER AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-14 US disclosed
EP-0641323-A1 CARBOSTYRIL DERIVATIVES AS MATRIX METALLOPROTEINASES INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-03-08 EP disclosed
WO-1994021612-A1 CARBOSTYRIL DERIVATIVES AS MATRIX METALLOPROTEINASES INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-29 WO disclosed