SCHEMBL3477421

SCHEMBL3477421

c1ccc(Nc2nc3cc(-c4ccc5c(c4)OCCCO5)ccc3o2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.55
ALDH1A1 P00352 4/20 0.51
NPC1 O15118 2/20 0.51
GAA P10253 2/20 0.51
RAB9A P51151 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
PKM P14618 1/20 0.51
DGAT1 O75907 1/20 0.50
LMNA P02545 4/20 0.48
MAPT P10636 4/20 0.48
HDAC6 Q9UBN7 2/20 0.48
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
USP2 O75604 4/20 0.46
HSD17B10 Q99714 4/20 0.46
MAPK1 P28482 3/20 0.46
TSHR P16473 3/20 0.46

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
SCHEMBL3478425 0.95 FAAH (0.57) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL3478220 0.90 CYP1A2 (0.57) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL3477459 0.80 FAAH (0.57) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL13436718 0.79 FAAH (0.57) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL3477906 0.79 FAAH (0.55) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL13436702 0.77 FAAH (0.61) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL3475856 0.77 FAAH (0.65) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL3474216 0.77 FAAH (0.62) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL3476446 0.77 FAAH (0.61) FAAHALDH1A1NPC1GAARAB9A
SCHEMBL3475208 0.77 FAAH (0.61) FAAHALDH1A1NPC1GAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed