SCHEMBL8952148

SCHEMBL8952148

CC(=Nc1ccccc1)NC1C2CC3CC(C2)CC1C3

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.49
KMT2A Q03164 1/20 0.46
HSD11B1 P28845 4/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
FAAH O00519 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
SCHEMBL7438390 0.80 SIGMAR1 (0.49) EPHX2KMT2ACNR1CNR2
SCHEMBL7438385 0.80 SIGMAR1 (0.49) EPHX2KMT2ACNR1CNR2
SCHEMBL8952256 0.79 EPHX2 (0.41) EPHX2KMT2AHSD11B1CNR1CNR2
SCHEMBL8952146 0.71 SIGMAR1 (0.51) EPHX2KMT2ACNR1CNR2FAAH
SCHEMBL8952147 0.71 SIGMAR1 (0.51) EPHX2KMT2ACNR1CNR2FAAH
SCHEMBL3073555 0.68 SIGMAR1 (0.61) EPHX2KMT2AHSD11B1
SCHEMBL19375483 0.68 KMT2A (0.56) EPHX2KMT2AHSD11B1FAAH
SCHEMBL15051964 0.68 KMT2A (0.65) EPHX2KMT2AHSD11B1FAAH
SCHEMBL1675682 0.68 KMT2A (0.74) EPHX2KMT2AHSD11B1CNR1CNR2
SCHEMBL3076737 0.67 KMT2A (0.55) EPHX2KMT2AHSD11B1

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-5552443-A TREATMENT OF PSYCHOSIS, ANXIETY AND AS HYPOTENSIVE AGENTS OREGON HEALTH SCIENCES UNIVERSITY (US) 1996-09-03 US disclosed
US-5308869-A TREATMENT OR PROPHYLAXIS OF ANXIETY IN AN ANIMAL STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION (US) 1994-05-03 US disclosed