SCHEMBL15034707

SCHEMBL15034707

COON1CCC(C)CC1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.33
MGLL Q99685 1/20 0.33
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
PRMT1 Q99873 1/20 0.32
PRMT8 Q9NR22 1/20 0.32
ACHE P22303 1/20 0.32
ALDH1A1 P00352 2/20 0.31
NPC1 O15118 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL18531200 0.67 PHGDH (0.37) PHGDHMGLLCARM1PRMT6PRMT1
SCHEMBL24011271 0.67 PHGDH (0.32) PHGDHMGLLCARM1PRMT6PRMT1
SCHEMBL18383598 0.67 ALDH1A1 (0.38) PHGDHMGLLCARM1PRMT6PRMT1
SCHEMBL9830002 0.65
SCHEMBL16181361 0.65 PHGDH (0.35) PHGDHMGLLCARM1PRMT6PRMT1
SCHEMBL1629925 0.64 PHGDH (0.42) PHGDHMGLLCARM1PRMT6PRMT1
SCHEMBL11612677 0.64 ALDH1A1 (0.41) PHGDHMGLLACHEALDH1A1NPC1
SCHEMBL6015475 0.64 ALDH1A1 (0.41) PHGDHMGLLACHEALDH1A1NPC1
SCHEMBL31035961 0.64 HPGD (0.35) PHGDHMGLLCARM1PRMT6PRMT1
SCHEMBL12227760 0.64 PHGDH (0.34) PHGDHMGLL

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013083775-A1 NEW COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-13 WO disclosed