SCHEMBL7549049

SCHEMBL7549049

O=CC1CNCC(COCCN2CCOCC2)C1c1ccc(OCCCOCc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
REN P00797 8/20 0.70
LTA4H P09960 1/20 0.44
MCHR1 Q99705 1/20 0.42
EPHX2 P34913 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 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
SCHEMBL7081660 0.92 REN (0.77) RENLTA4HMCHR1EPHX2HTT
SCHEMBL7081656 0.92 REN (0.77) RENLTA4HMCHR1EPHX2HTT
SCHEMBL6041928 0.85 REN (0.56) RENLTA4HMCHR1EPHX2HTT
SCHEMBL7560382 0.84 REN (0.70) RENLTA4HMCHR1KMT2ANPC1
SCHEMBL7131244 0.82 REN (1.00) REN
SCHEMBL6041247 0.82 REN (1.00) REN
SCHEMBL6041249 0.82 REN (1.00) REN
SCHEMBL6041330 0.81 REN (0.75) RENLTA4HMCHR1EPHX2
SCHEMBL6043618 0.81 REN (0.75) RENLTA4HMCHR1EPHX2
SCHEMBL6043614 0.81 REN (0.75) RENLTA4HMCHR1EPHX2

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-0863875-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1998-09-16 EP disclosed
WO-1997009311-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1997-03-13 WO disclosed