SCHEMBL7674584

SCHEMBL7674584

CCOC(=O)N1CCC2(CC1)c1ccccc1Sc1ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.52
BCHE P06276 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 2/20 0.47
OPRD1 P41143 2/20 0.47
OPRK1 P41145 2/20 0.47
OPRM1 P35372 1/20 0.47
GAA P10253 2/20 0.46
TSHR P16473 2/20 0.46
CYP2C19 P33261 1/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46

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
SCHEMBL7677849 0.83 BCHE (0.51) BCHEMEN1KMT2AATMOPRD1
SCHEMBL7679291 0.81 APP (0.52) APPKMT2AL3MBTL1MAPTOPRD1
SCHEMBL7678227 0.79 APP (0.50) APPMEN1KMT2AL3MBTL1MAPT
SCHEMBL21581202 0.79 OPRD1 (0.63) APPMAPTOPRD1OPRK1OPRM1
SCHEMBL8915496 0.75 OPRL1 (0.53) APPMEN1KMT2AL3MBTL1MAPT
SCHEMBL6247508 0.75 APP (0.60) APPL3MBTL1MAPTGAATSHR
SCHEMBL6153677 0.74 APP (0.50) APPL3MBTL1MAPTGAATSHR
SCHEMBL22874143 0.73 APP (0.56) APPL3MBTL1MAPTOPRD1OPRK1
SCHEMBL13228095 0.73 HDAC1 (0.54) APPL3MBTL1MAPTGAASMN1; SMN2
SCHEMBL7680939 0.73 OPRM1 (0.46) BCHEKMT2AOPRM1GAACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6387893-B1 ADRENERGIC BLOCKING AGENT; BENIGN PROSATATIC HYPERPLASIA MERCK & CO., INC. 2002-05-14 US disclosed