SCHEMBL8395642

SCHEMBL8395642

O=CN(OCCc1ccccc1)C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
EPHX2 P34913 3/20 0.40
G6PC1 P35575 1/20 0.39
OPRM1 P35372 5/20 0.39
OPRK1 P41145 4/20 0.39
OPRD1 P41143 3/20 0.39
TAAR1 Q96RJ0 1/20 0.38
HTT P42858 1/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
EPHX1 P07099 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
AGER Q15109 3/20 0.36
MTNR1A P48039 1/20 0.36
MLYCD O95822 1/20 0.36

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
SCHEMBL8392424 1.00 L3MBTL1 (0.45) L3MBTL1USP2HPGDHSD17B10EPHX2
SCHEMBL8396229 0.98 L3MBTL1 (0.43) L3MBTL1USP2HPGDHSD17B10EPHX2
SCHEMBL8396298 0.97 OPRM1 (0.41) L3MBTL1USP2HPGDHSD17B10OPRM1
SCHEMBL8391958 0.92 CA1 (0.38) L3MBTL1EPHX2OPRM1OPRK1OPRD1
SCHEMBL8394934 0.92 OPRM1 (0.45) L3MBTL1USP2HPGDHSD17B10EPHX2
SCHEMBL8394782 0.92 OPRM1 (0.45) L3MBTL1USP2HPGDHSD17B10EPHX2
SCHEMBL8397670 0.90 OPRM1 (0.46) L3MBTL1EPHX2OPRM1OPRK1OPRD1
SCHEMBL8395298 0.88 OPRM1 (0.44) L3MBTL1OPRM1OPRK1OPRD1SMN1; SMN2
SCHEMBL8393611 0.84 MEN1 (0.43) EPHX2OPRM1OPRK1OPRD1
SCHEMBL28601901 0.76 TSHR (0.38) L3MBTL1EPHX2OPRM1NPC1TSHR

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
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed