SCHEMBL8395298

SCHEMBL8395298

O=CN(OCCCc1ccccc1)C1CCC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
OPRK1 P41145 3/20 0.42
OPRD1 P41143 2/20 0.42
HRH3 Q9Y5N1 2/20 0.41
IDO1 P14902 1/20 0.41
LMNA P02545 1/20 0.40
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DRD2 P14416 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL8397670 0.99 OPRM1 (0.46) OPRM1MEN1KMT2AOPRK1OPRD1
SCHEMBL8394782 0.97 OPRM1 (0.45) OPRM1MEN1KMT2AOPRK1OPRD1
SCHEMBL8394934 0.97 OPRM1 (0.45) OPRM1MEN1KMT2AOPRK1OPRD1
SCHEMBL8393611 0.95 MEN1 (0.43) OPRM1MEN1KMT2AOPRK1OPRD1
SCHEMBL8396298 0.91 OPRM1 (0.41) OPRM1OPRK1OPRD1L3MBTL1
SCHEMBL8396229 0.90 L3MBTL1 (0.43) OPRM1OPRK1OPRD1L3MBTL1
SCHEMBL8395642 0.88 L3MBTL1 (0.45) OPRM1OPRK1OPRD1SMN1; SMN2L3MBTL1
SCHEMBL8392424 0.88 L3MBTL1 (0.45) OPRM1OPRK1OPRD1SMN1; SMN2L3MBTL1
SCHEMBL8391958 0.86 CA1 (0.38) OPRM1MEN1KMT2AOPRK1OPRD1
SCHEMBL8394048 0.73 IDO1 (0.47) OPRM1IDO1LMNASIGMAR1

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