SCHEMBL6668265

SCHEMBL6668265

Cn1ccc(CNC2CC2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.48
EPHX2 P34913 1/20 0.46
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
NAMPT P43490 1/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
OPRL1 P41146 2/20 0.35
OPRM1 P35372 1/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
ROCK2 O75116 1/20 0.35
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
RORC P51449 1/20 0.34
GLS O94925 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
SLC6A4 P31645 1/20 0.34
ACHE P22303 1/20 0.34

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
SCHEMBL26269465 0.92 LMNA (0.46) KDM1AEPHX2KMT2ALMNAACHE
SCHEMBL31324529 0.77 TRPV3 (0.44) KDM1AEPHX2
SCHEMBL30818072 0.76 MEN1 (0.33) KMT2AOPRL1MEN1RAB9AHTR2A
SCHEMBL178474 0.75
SCHEMBL24186196 0.73 EPHX2 (0.47) KDM1AEPHX2DDB1CRBNNAMPT
SCHEMBL18924762 0.73 EPHX2 (0.51) KDM1AEPHX2DDB1CRBNNAMPT
SCHEMBL29541525 0.72 DDB1 (0.41) KDM1AEPHX2DDB1CRBNKMT2A
SCHEMBL2259759 0.72 EPHX2 (0.58) KDM1AEPHX2DDB1CRBNNAMPT
SCHEMBL104749 0.70 EPHX2 (0.49) KDM1AEPHX2DDB1CRBNNAMPT
SCHEMBL5652881 0.70 EPHX2 (0.49) KDM1AEPHX2DDB1CRBNNAMPT

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
EP-1324985-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2004-10-06 EP disclosed
EP-1324985-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2003-07-09 EP disclosed
WO-2002028831-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2002-04-11 WO disclosed