SCHEMBL8097215

SCHEMBL8097215

CC(C)(NC(=O)C1CC1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.60
GLA P06280 1/20 0.51
ACKR3 P25106 1/20 0.47
SCN9A Q15858 1/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.45
GAA P10253 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.45
GFER P55789 1/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
PRCP P42785 1/20 0.43
DPP4 P27487 1/20 0.43
HPGD P15428 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42

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
SCHEMBL17972905 0.82 SSTR4 (0.50) SSTR4ACKR3LMNANPC1RAB9A
SCHEMBL2447500 0.81 SSTR4 (0.59) SSTR4SCN9ALMNAMAPTKMT2A
SCHEMBL17972884 0.80 ATM (0.50) SSTR4ACKR3LMNANPC1RAB9A
SCHEMBL21146341 0.79 SSTR4 (0.47) SSTR4MAPTSMN1; SMN2
SCHEMBL22424970 0.79 SSTR4 (0.47) SSTR4MAPTSMN1; SMN2
SCHEMBL28250921 0.79 GAA (0.45) GLALMNAMEN1GAAMAPT
SCHEMBL610346 0.78 NOTUM (0.49) SSTR4LMNAMAPTNPC1RAB9A
SCHEMBL12227208 0.78 HTT (0.66) LMNAMEN1MAPTKMT2AKDM4E
SCHEMBL2604732 0.77 SSTR4 (0.51) SSTR4ACKR3SCN9ALMNAGAA
SCHEMBL18347306 0.77 SSTR4 (0.55) SSTR4SCN9ANPC1RAB9AHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6057371-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-05-02 US disclosed
EP-0591426-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1994-04-13 EP disclosed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO disclosed