SCHEMBL7848451

SCHEMBL7848451

OC[C@@H](O)CCc1cc2ccccc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.50
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
HRH3 Q9Y5N1 3/20 0.48
CHRNA7 P36544 2/20 0.43
IDO1 P14902 1/20 0.42
AHR P35869 1/20 0.41
OPRK1 P41145 1/20 0.40
HRH4 Q9H3N8 1/20 0.40

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
SCHEMBL5693168 0.83 LOXL2 (0.53) LOXL2MTNR1AMTNR1BHRH3AHR
SCHEMBL5858443 0.83 LOXL2 (0.53) LOXL2MTNR1AMTNR1BHRH3AHR
SCHEMBL29759400 0.79 LOXL2 (0.60) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL2261199 0.79 LOXL2 (0.60) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL7169246 0.78 LOXL2 (0.69) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL31059889 0.78 LOXL2 (0.69) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL5350024 0.78 LOXL2 (0.47) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL6254564 0.78 LOXL2 (0.55) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL1724157 0.78 LOXL2 (0.59) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL28483740 0.77 LOXL2 (0.53) LOXL2MTNR1AMTNR1BHRH3CHRNA7

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
EP-1161429-A2 HETEROCYCLIC COMPOUNDS AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-12-12 EP disclosed
WO-2000055155-A2 HETEROCYCLIC COMPOUNDS AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-09-21 WO disclosed